Gas de Sintesis-5

Constantes para la ecuacin de Benedict - Rubin
Gas Ao Bo Cox10-6 a b cx10-6

Metano 1.855 0.0426 0.02257 0.494 0.00338004 0.002545
etileno 3.33958 0.0556833 0.13114 0.259 0.0086 0.02112
etano 4.15556 0.0627724 0.179592 0.34516 0.011122 0.032767
Propileno 6.1122 0.0850647 0.439182 0.774056 0.0187059 0.102611
Propano 6.87225 0.097313 0.508256 0.9477 0.0225 0.129
Isobutano 10.23264 0.137544 0.849943 1.93763 0.0424352 0.28601
Isobutileno 8.95325 0.116025 0.92728 1.6927 0.0348156 0.27492
Butano normal 10.0847 0.124361 0.99283 1.88231 0.0399983 0.3164
Isopentano 12.7959 0.160053 1.74632 3.7562 0.066812 0.695
Pentan normal 12.1794 0.156751 2.12121 4.0748 0.066812 0.82417
Hexano normal 14.4373 0.1778813 3.31935 7.11671 0.109131 1.51276
Heptano normal 17.5206 0.199005 4.74574 10.36475 0.151954 2.47
Fuente Termodinamica para ingeiieros Balshizer
Dioxido de carbono 1.34122
Constantes para clculo
Gas Ao Bo Co a b c
Metano 1.855 0.0426 22570 0.494 0.00338004 2545
Metano 1.79894 0.0454625 31838.2 0.04352 0.00252033 3587.8
etileno 3.33958 0.0556833 131140 0.259 0.0086 21120
etano 4.15556 0.0627724 179592 0.34516 0.011122 32767
Propileno 6.1122 0.0850647 439182 0.774056 0.0187059 102611
Propano 6.87225 0.097313 508256 0.9477 0.0225 129000
Isobutano 10.23264 0.137544 849943 1.93763 0.0424352 286010
Isobutileno 8.95325 0.116025 927280 1.6927 0.0348156 274920
Butano normal 10.0847 0.124361 992830 1.88231 0.0399983 316400
Isopentano 12.7959 0.160053 1746320 3.7562 0.066812 695000
Pentan normal 12.1794 0.156751 2121210 4.0748 0.066812 824170
Hexano normal 14.4373 0.1778813 3319350 7.11671 0.109131 1512760
Heptano normal 17.5206 0.199005 4745740 10.36475 0.151954 2470000
Dioxido de carbono 2.7374 0.049909 138564 0.13681 0.0072105 14918.3
Dioxido de carbono 2.5104 0.0448842 147440.5 0.13681 0.00412381 14918.3
Dioxido de carbono 2.7634 0.045628 113330 0.051689 0.0030819 7067.2
Nitrogeno N2 1.1925 0.0458 5889.1 0.0149 0.00198154 548.064
Oxigeno 1.4988 0.046524 3861.7 -0.040507 -0.00027963 -203.76
Hidrogeno 0.097319 0.018041 389.14 -0.0092211 0.00017976 -246.13
NH3 3.78928 0.051641 178567 0.10354 0.000719561 157.536
alfa x 10 3 gama x 10 2
0.124359 0.6
0.178 0.923
0.243389 1.18
0.455696 1.829
0.607175 2.2
1.97408 3.4
0.910889 2.95945
1.10132 3.4
1.7 4.63
1.81 4.75
2.80186 6.66849
4.35611 9
alfa gama
0.000124359 0.006
0.00033 0.0105
0.000178 0.00923
0.000243389 0.0118
0.000455696 0.01829
0.000607175 0.022
0.00197408 0.034
0.000910889 0.0295945
0.00110132 0.034
0.0017 0.0463
0.00181 0.0475
0.00280186 0.0666849
0.00435611 0.09
0.000084658 0.005393
0.000084658 0.005253
0.00011271 0.00494
0.000291545 0.0075
0.000008641 0.00359
-3.4215E-06 0.00189
4.65189E-06 0.0198
CAPACIDADES CALORIFICAS DE LIQUIDOS
CP = A + BT + CT2 [J/mol K]
Rango: TN a TX [K]
T= 200 C <---- Ingrese temperatura

No. = 29 <---- Ingrese No. de Sustancia
Sustancia = CH4 METHANE
A B C
Constantes = 54.87106 -0.094678 0.0008593 Tmin
Valor Calculado: Cp = 202.44 J/mol K -182.45
202.34
Ref.: - Yaws, Chem.Eng. Abril 1992, p. 130

- Himmelblau, 6a. ed.
PM Constantes CP
[kg/kmol]
No. No./ Frmula Nombre A B C
1 CCL4 CARBON-TETRACHLORIDE 153.823 139.7338 -0.2045 5.87E-04
2 CCL3F TRICHLOROFLUOROMETHANE 137.368 111.6071 -0.036574 2.37E-04
3 CCL2F2 DICHLORODIFLUOROMETHANE 120.913 97.75903 -2.94E-02 3.01E-04
4 CCLF3 CHLOROTRIFLUOROMETHANE 104.459 88.98669 -3.48E-02 4.40E-04
5 CF4 CARBON-TETRAFLUORIDE 88.005 86.44433 -0.076117 8.45E-04
6 CO CARBON-MONOXIDE 28.010 61.53487 -0.176969 2.05E-03
7 CO2 CARBON-DIOXIDE 44.010 98.63061 -0.294153 9.33E-04
8 COS CARBONYL-SULFIDE 60.070 71.81666 -2.95E-02 2.38E-04
9 CS2 CARBON-DISULFIDE 76.131 68.39258 -4.57E-02 2.43E-04
10 CHCL3 CHLOROFORM 119.377 110.5378 -0.121567 4.41E-04
11 CHCL2F DICHLOROFLUOROMETHANE 102.923 98.07049 -2.61E-02 2.22E-04
12 CHCLF2 CHLORODIFLUOROMETHANE 86.469 85.63914 -2.90E-02 2.95E-04
13 CHF3 TRIFLUOROMETHANE 70.014 79.87337 -5.37E-02 4.71E-04
14 CHI3 TRIIODOMETHANE 393.732 194.6557 -0.091508 1.86E-04
15 CHNS ISOTHIOCYANIC-ACID 59.086
16 CH2CL2 DICHLOROMETHANE 84.933 117.1086 -0.149637 6.16E-04
17 CH2CLF CHLOROFLUOROMETHANE 68.478 86.91451 -3.60E-02 2.66E-04
18 CH2F2 DIFLUOROMETHANE 52.024 70.30925 -2.51E-02 2.87E-04
19 CH2I2 DIIODOMETHANE 267.835 185.3474 -0.180553 4.69E-04
20 CH2O FORMALDEHYDE 30.026 77.73247 -5.67E-02 3.24E-04
21 CH2O2 FORMIC-ACID 46.026 133.4323 -0.347511 7.86E-04
22 CH3BR BROMOMETHANE 94.939 101.7486 -4.60E-02 2.50E-04
23 CH3CL CHLOROMETHANE 50.488 72.76645 -4.40E-02 2.29E-04
24 CH3F FLUOROMETHANE 34.033 64.32159 -5.29E-02 3.65E-04
25 CH3I IODOMETHANE 141.939 114.0235 -0.165981 5.81E-04
26 CH3NO2 NITROMETHANE 61.040 114.6402 -0.174907 4.96E-04
27 CH3NO2 METHYL-NITRITE 61.040
28 CH3NO3 METHYL-NITRATE 77.040
29 CH4 METHANE 16.043 54.87106 -9.47E-02 8.59E-04
30 CH4O METHANOL 32.042 74.86274 -0.102315 4.07E-04
31 CH4S METHANETHIOL 48.103 82.76998 -2.22E-02 1.75E-04
32 CH5N METHYLAMINE 31.057 97.01632 -7.24E-02 3.49E-04
33 C2CL4 TETRACHLOROETHENE 165.834 145.6195 -0.179537 5.12E-04
34 C2CL6 HEXACHLOROETHANE 236.740
35 C2CL3F3 112TRICHLOROTRIFLUOROETHANE 187.376 189.2332 -0.366073 1.07E-03
36 C2CL2F4 12DICHLOROTETRAFLUOROETHANE 170.921 161.6632 -0.104512 5.07E-04
37 C2CLF5 CHLOROPENTAFLUOROETHANE 154.467
38 C2F4 TETRAFLUOROETHENE 100.015
39 C2F6 HEXAFLUOROETHANE 138.012 139.8775 -0.265002 1.13E-03
40 C2N2 CYANOGEN 52.035
41 C2HCL3 TRICHLOROETHENE 131.388 143.1514 -0.127892 5.22E-04
42 C2HCL5 PENTACHLOROETHANE 202.294 169.0124 -0.1664 4.94E-04
43 C2HF3 TRIFLUOROETHENE 82.025 70.46147 -1.73E-02 2.45E-04
44 C2H2 ACETYLENE(ETHYNE) 26.038
45 C2H2CL2 1,1-DICHLOROETHENE 96.944 108.4602 -0.11568 5.64E-04
46 C2H2CL2 CIS-1,2-DICHLOROETHENE 96.944 83.08283 -9.75E-02 3.75E-04
47 C2H2CL2 TRANS-1,2-DICHLOROETHENE 96.944 87.52022 -0.139467 4.47E-04
48 C2H2CL4 1,1,2,2-TETRACHLOROETHANE 167.849 149.8382 -0.198696 5.67E-04
49 C2H2F2 1,1-DIFLUOROETHENE 64.035 61.54249 -5.21E-02 3.64E-04
50 C2H2F2 CIS-1,2-DIFLUOROETHENE 64.035 79.3938 -2.22E-02 2.54E-04
51 C2H2F2 TRANS-1,2-DIFLUOROETHENE 64.035 79.3938 -2.22E-02 2.54E-04
52 C2H2O KETENE 42.037
53 C2H3BR BROMOETHYLENE 106.949 95.70229 -0.019504 1.91E-04
54 C2H3CL CHLOROETHENE 62.499 69.85845 -1.62E-02 1.77E-04
55 C2H3CL3 1,1,2-TRICHLOROETHANE 133.404 148.9297 -0.175179 5.36E-04
56 C2H3CLO ACETYL-CHLORIDE 78.498 102.9433 -0.09158 4.46E-04
57 C2H3F FLUOROETHENE 46.044 48.64886 -3.14E-02 2.32E-04
58 C2H3F3 1,1,1-TRIFLUOROETHANE 84.041 77.70468 -8.02E-02 4.07E-04
59 C2H3N ACETONITRILE 41.052 96.79542 -0.193776 5.60E-04
60 C2H4 ETHYLENE 28.054 62.89727 -3.80E-02 3.79E-04
61 C2H4BR2 1,2-DIBROMOETHANE 187.861 146.2965 -0.144732 3.84E-04
62 C2H4CL2 1,1-DICHLOROETHANE 98.960 117.1937 -0.114104 4.97E-04
63 C2H4CL2 1,2-DICHLOROETHANE 98.960 130.2376 -0.177718 5.39E-04
64 C2H4F2 1,1-DIFLUOROETHANE 66.050 83.2697 -5.50E-02 3.17E-04
65 C2H4I2 1,2-DIIODOETHANE 281.862 186.357 -9.34E-02 2.15E-04
66 C2H4O ETHYLENE-OXIDE 44.053 79.81366 -2.75E-02 1.82E-04
67 C2H4O ACETALDEHYDE 44.053 54.6987 -2.21E-02 1.48E-04
68 C2H4O2 ACETIC-ACID 60.052 155.4802 -0.326595 7.44E-04
69 C2H4O2 METHYL-FORMATE 60.052
70 C2H4OS THIOACETIC-ACID 76.113
71 C2H4S THIACYCLOPROPANE 60.114 81.29564 -8.17E-02 3.71E-04
72 C2H5BR BROMOETHANE 108.965 89.6772 -5.96E-02 3.32E-04
73 C2H5CL CHLOROETHANE 64.514 95.86747 -2.27E-02 2.03E-04
74 C2H5F FLUOROETHANE 48.060 77.39183 -3.34E-02 2.67E-04
75 C2H5I IODOETHANE 155.966 116.5589 -0.101416 4.70E-04
76 C2H5N ETHYLENIMINE 43.068 104.1616 -0.158061 5.68E-04
77 C2H5NO2 NITROETHANE 75.067
78 C2H5NO3 ETHYL-NITRATE 91.066
79 C2H6 ETHANE 30.069 66.3402 -2.09E-02 3.04E-04
80 C2H6O METHYL-ETHER 46.069 95.20254 -0.02866 2.50E-04
81 C2H6O ETHYL-ALCOHOL 46.069 100.922 -0.111839 4.99E-04
82 C2H6O2 ETHYLENE-GLYCOL 62.068 153.0029 -0.114819 3.32E-04
83 C2H6S METHYL-SULFIDE 62.129 106.7474 -0.116326 5.08E-04
84 C2H6S ETHANETHIOL 62.129 99.36189 -0.06302 4.26E-04
85 C2H6S2 METHYL-DISULFIDE 94.189 138.1671 -0.107053 4.40E-04
86 C2H7N ETHYLAMINE 45.084 122.6822 -6.93E-02 3.23E-04
87 C2H7N DIMETHYLAMINE 45.084 129.4855 -7.80E-02 3.85E-04
88 C3H3N ACRYLONITRILE 53.063 106.7761 -0.156184 5.65E-04
89 C3H4 ALLENE(PROPADIENE) 40.065 91.28093 -4.08E-02 3.04E-04
90 C3H4 PROPYNE(METHYLACETYLENE) 40.065 100.2229 -6.37E-02 3.37E-04
91 C3H4O2 ACRYLIC-ACID 72.063 178.0107 -0.303313 7.18E-04
92 C3H5BR 3-BROMO-1-PROPENE 120.976 113.8498 -7.99E-02 4.20E-04
93 C3H5CL 3-CHLORO-1-PROPENE 76.525 101.2799 -7.59E-02 4.41E-04
94 C3H5CL3 1,2,3-TRICHLOROPROPANE 147.431 191.8314 -0.224638 6.13E-04
95 C3H5I 3-IODO-1-PROPENE 167.977 130.12 -0.102528 4.51E-04
96 C3H5N PROPIONITRILE 55.079 141.6414 -0.179313 6.79E-04
97 C3H6 PROPENE 42.080 82.1637 -1.28E-02 2.50E-04
98 C3H6 CYCLOPROPANE 42.080 76.03351 -0.033698 2.38E-04
99 C3H6BR2 1,2-DIBROMOPROPANE 201.888 157.7165 -0.10292 3.79E-04
100 C3H6CL2 1,2-DICHLOROPROPANE 112.986 143.738 -0.15408 6.28E-04
103 C3H6I2 1,2-DIIODOPROPANE 295.889 196.4658 -0.145651 4.21E-04
104 C3H6O PROPYLENE-OXIDE 58.080 113.0834 -0.150854 6.73E-04
105 C3H6O ALLYL-ALCOHOL 58.080 107.3626 -9.01E-02 4.56E-04
106 C3H6O PROPIONALDEHYDE 58.080 123.74 -0.153727 5.91E-04
107 C3H6O ACETONE 58.080 117.8108 -0.159245 6.34E-04
108 C3H6S THIACYCLOBUTANE 74.140 109.2008 -0.111822 4.12E-04
109 C3H7BR 1-BROMOPROPANE 122.992 127.8446 -9.82E-02 4.78E-04
110 C3H7BR 2-BROMOPROPANE 122.992 114.7829 -0.110824 4.65E-04
111 C3H7CL 1-CHLOROPROPANE 78.541 116.3806 -9.68E-02 5.10E-04
112 C3H7CL 2-CHLOROPROPANE 78.541 99.73264 -9.47E-02 4.74E-04
113 C3H7F 1-FLUOROPROPANE 62.087 87.49543 -1.99E-02 2.24E-04
114 C3H7F 2-FLUOROPROPANE 62.087 87.22685 -3.38E-02 2.52E-04
115 C3H7I 1-IODOPROPANE 169.992 129.9818 -0.101429 4.51E-04
116 C3H7I 2-IODOPROPANE 169.992 126.7354 -0.112013 4.65E-04
117 C3H7NO2 1-NITROPROPANE 89.094
118 C3H7NO2 2-NITROPROPANE 89.094
119 C3H7NO3 PROPYL-NITRATE 105.093
120 C3H7NO3 ISOPROPYL-NITRATE 105.093
121 C3H8 PROPANE 44.096 87.31411 -1.24E-02 2.59E-04
122 C3H8O ETHYL-METHYL-ETHER 60.096 123.0474 -3.60E-02 3.03E-04
123 C3H8O PROPYL-ALCOHOL 60.096 119.3875 -0.100208 5.01E-04
124 C3H8O ISOPROPYL-ALCOHOL 60.096 146.1573 -0.192824 7.30E-04
125 C3H8S ETHYL-METHYL-SULFIDE 76.156 131.5528 -0.121917 5.55E-04
126 C3H8S 1-PROPANETHIOL 76.156 129.5992 -0.100511 4.99E-04
127 C3H8S 2-PROPANETHIOL 76.156 126.6698 -8.97E-02 5.13E-04
128 C3H9N PROPYLAMINE 59.111 158.0876 -0.2067 7.95E-04
129 C3H9N TRIMETHYLAMINE 59.111 121.1725 -4.68E-02 3.04E-04
130 C4F8 OCTAFLUOROCYCLOBUTANE 200.031 220.3123 -0.332586 1.05E-03
131 C4H2 BUTADIYNE(BIACETYLENE) 50.060
132 C4H4 1BUTEN3YNE(VINYLACETYLENE) 52.076
133 C4H4O FURAN 68.075 107.4003 -0.130643 5.28E-04
134 C4H4S THIOPHENE 84.136 127.2085 -0.158078 4.93E-04
135 C4H6 1,2-BUTADIENE 54.091 119.747 -3.52E-02 2.88E-04
136 C4H6 1,3-BUTADIENE 54.091 113.862 -5.66E-02 3.28E-04
137 C4H6 1-BUTYNE(ETHYLACETYLENE) 54.091 119.8088 -3.29E-02 2.60E-04
138 C4H6 2-BUTYNE(DIMETHYLACETYLENE) 54.091 158.9053 -0.306452 8.88E-04
139 C4H6 CYCLOBUTENE 54.091 72.56911 -2.48E-02 1.72E-04
140 C4H6O3 ACETIC-ANHYDRIDE 102.089 182.4041 -0.201667 7.11E-04
141 C4H7N BUTYRONITRILE 69.106 133.2964 -0.122428 5.37E-04
142 C4H7N ISOBUTYRONITRILE 69.106 128.0073 -0.166514 5.72E-04
143 C4H8 1-BUTENE 56.107 103.2326 -9.50E-03 2.34E-04
144 C4H8 2-BUTENE,CIS 56.107 111.0482 -3.30E-02 2.76E-04
145 C4H8 2-BUTENE,TRANS 56.107 112.708 -0.056768 3.18E-04
146 C4H8 2-METHYLPROPENE 56.107 113.1346 -0.036151 3.01E-04
147 C4H8 CYCLOBUTANE 56.107 99.08068 -4.45E-02 2.34E-04
148 C4H8BR2 1,2-DIBROMOBUTANE 215.915 161.1101 -9.14E-02 3.55E-04
149 C4H8BR2 2,3-DIBROMOBUTANE 215.915 164.727 -0.118608 3.86E-04
150 C4H8I2 1,2-DIIODOBUTANE 309.916 194.1194 -0.180467 4.67E-04
151 C4H8O BUTYRALDEHYDE 72.107 146.5049 -0.142105 6.04E-04
152 C4H8O 2-BUTANONE 72.107 150.1966 -0.17481 6.76E-04
153 C4H8O2 P-DIOXANE 88.106
154 C4H8O2 ETHYL-ACETATE 88.106 162.9878 -0.207054 7.77E-04
155 C4H8S THIACYCLOPENTANE 88.167 130.8822 -9.51E-02 4.11E-04
156 C4H9BR 1-BROMOBUTANE 137.019 162.0561 -0.106133 5.26E-04
157 C4H9BR 2-BROMOBUTANE 137.019 123.6349 -8.34E-02 4.15E-04
158 C4H9BR 2-BROMO-2-METHYLPROPANE 137.019 138.7352 -0.205484 5.76E-04
159 C4H9CL 1-CHLOROBUTANE 92.568 116.3484 -9.28E-02 4.72E-04
160 C4H9CL 2-CHLOROBUTANE 92.568 110.9378 -7.86E-02 4.41E-04
161 C4H9CL 1-CHLORO-2-METHYLPROPANE 92.568 111.2874 -8.63E-02 4.67E-04
162 C4H9CL 2-CHLORO-2-METHYLPROPANE 92.568 131.2157 -0.245518 6.92E-04
163 C4H9I 2-IODO-2-METHYLPROPANE 184.019 142.7281 -0.168372 5.24E-04
164 C4H9N PYRROLIDINE 71.122 152.5666 -0.143647 5.19E-04
165 C4H9NO2 1-NITROBUTANE 103.120
166 C4H9NO2 2-NITROBUTANE 103.120
167 C4H10 BUTANE 58.123 120.0291 -3.78E-02 3.09E-04
168 C4H10 2-METHYLPROPANE(ISOBUTANE) 58.123 114.874 -2.63E-02 2.97E-04
169 C4H10O ETHYL-ETHER 74.122 152.2542 -0.183636 8.60E-04
170 C4H10O METHYL-PROPYL-ETHER 74.122 144.4045 -0.163912 7.75E-04
171 C4H10O METHYL-ISOPROPYL-ETHER 74.122 141.8667 -0.165266 7.85E-04
172 C4H10O BUTYL-ALCOHOL 74.122 162.6767 -0.141214 6.23E-04
173 C4H10O SEC-BUTYL-ALCOHOL 74.122 182.6186 -0.171806 7.83E-04
174 C4H10O TERT-BUTYL-ALCOHOL 74.122 248.6719 -0.295972 7.25E-04
175 C4H10S ETHYLSULFIDE 90.183 157.394 -0.12864 5.81E-04
176 C4H10S ISOPROPYL-METHYL-SULFIDE 90.183 150.789 -0.130866 5.80E-04
177 C4H10S METHYL-PROPYL-SULFIDE 90.183 159.495 -0.120917 5.80E-04
178 C4H10S 1-BUTANETHIOL 90.183 156.0201 -0.104689 5.26E-04
179 C4H10S 2-BUTANETHIOL 90.183 149.8146 -8.03E-02 5.07E-04
180 C4H10S 2-METHYL-1-PROPANETHIOL 90.183 150.0248 -7.51E-02 4.96E-04
181 C4H10S 2-METHYL-2-PROPANETHIOL 90.183 203.4529 -0.385527 9.75E-04
182 C4H10S2 ETHYL-DISULFIDE 122.243 190.3945 -0.108326 4.99E-04
183 C4H11N BUTYLAMINE 73.138 199.6609 -0.291162 9.23E-04
184 C4H11N SEC-BUTYLAMINE 73.138 170.6339 -0.194429 7.67E-04
185 C4H11N TERT-BUTYLAMINE 73.138 157.2374 -0.232101 8.34E-04
186 C4H11N DIETHYLAMINE 73.138 179.3763 -0.305907 9.63E-04
187 C5H5N PYRIDINE 79.101 147.6396 -0.141253 4.60E-04
188 C5H6S 2-METHYLTHIOPHENE 98.162 141.5368 -0.12849 4.62E-04
189 C5H6S 3-METHYLTHIOPHENE 98.162 140.3606 -0.120846 4.49E-04
190 C5H8 1,2-PENTADIENE 68.118 139.9823 -0.10414 6.16E-04
191 C5H8 1,3-PENTADIENE,CIS 68.118 149.8778 -0.190399 7.58E-04
192 C5H8 1,3-PENTADIENE,TRANS 68.118 152.0914 -0.20019 7.89E-04
193 C5H8 1,4-PENTADIENE 68.118 120.6581 -9.19E-02 5.96E-04
194 C5H8 2,3-PENTADIENE 68.118 145.5565 -0.120435 6.43E-04
195 C5H8 3-METHYL-1,2-BUTADIENE 68.118 141.5091 -0.141993 6.81E-04
196 C5H8 2-METHYL-1,3-BUTADIENE 68.118 127.0137 -0.107643 6.55E-04
197 C5H8 1-PENTYNE 68.118 142.98 -0.150049 6.84E-04
198 C5H8 2-PENTYNE 68.118 156.8017 -0.1406 6.66E-04
199 C5H8 3-METHYL-1-BUTYNE 68.118 134.9212 -0.166645 6.88E-04
200 C5H8 CYCLOPENTENE 68.118 103.1864 -7.42E-02 4.39E-04
201 C5H8 SPIROPENTANE 68.118 112.0773 -0.098977 4.77E-04
202 C5H10 1-PENTENE 70.134 124.7965 -7.83E-02 6.03E-04
203 C5H10 2-PENTENE,CIS 70.134 127.2634 -9.20E-02 6.10E-04
204 C5H10 2-PENTENE,TRANS 70.134 129.2951 -0.110358 6.48E-04
205 C5H10 2-METHYL-1-BUTENE 70.134 132.8531 -0.117965 6.79E-04
206 C5H10 3-METHYL-1-BUTENE 70.134 136.8813 -1.74E-02 2.73E-04
207 C5H10 2-METHYL-2-BUTENE 70.134 130.2604 -0.121847 6.68E-04
208 C5H10 CYCLOPENTANE 70.134 116.2369 -0.12205 5.20E-04
209 C5H10BR2 2,3-DIBROMO-2-METHYLBUTANE 229.942 180.6011 -0.170993 4.39E-04
210 C5H10O VALERALDEHYDE 86.133 172.299 -0.174832 6.95E-04
211 C5H10O 2-PENTANONE 86.133 178.4802 -0.214575 7.70E-04
212 C5H10S THIACYCLOHEXANE 102.194 184.4118 -0.244782 5.92E-04
213 C5H10S CYCLOPENTANETHIOL 102.194 143.2029 -7.26E-02 3.85E-04
214 C5H11BR 1-BROMOPENTANE 151.045 143.4135 -0.11807 4.78E-04
215 C5H11CL 1-CHLOROPENTANE 106.594 132.5936 -0.130476 5.40E-04
216 C5H11CL 1-CHLORO-3-METHYLBUTANE 106.594 127.9112 -0.112488 4.95E-04
217 C5H11CL 2-CHLORO-2-METHYLBUTANE 106.594 129.3675 -0.1476 5.39E-04
218 C5H12 PENTANE 72.150 143.6066 -0.144766 7.62E-04
219 C5H12 2-METHYLBUTANE(ISOPENTANE) 72.150 132.3586 -9.54E-02 6.79E-04
220 C5H12 2,2-DIMETHYPROPANE 72.150 149.7929 -0.20549 5.80E-04
221 C5H12O METHYL-TERT-BUTYL-ETHER 88.149 162.0418 -0.173412 7.83E-04
222 C5H12O PENTYL-ALCOHOL 88.149 190.6768 -0.189225 6.91E-04
223 C5H12O TERT-PENTYL-ALCOHOL 88.149 239.6828 -0.253425 5.69E-04
224 C5H12S BUTYL-METHYL-SULFIDE 104.209 187.2402 -0.147804 6.31E-04
225 C5H12S ETHYL-PROPYL-SULFIDE 104.209 180.3185 -0.121054 5.97E-04
226 C5H12S 2-METHYL-2-BUTANETHIOL 104.209 165.3722 -0.120061 5.55E-04
227 C5H12S 1-PENTANETHIOL 104.209 193.9695 -0.163785 6.21E-04
228 C6CL6 HEXACHLOROBENZENE 284.784
229 C6F6 HEXAFLUOROBENZENE 186.056
230 C6H4CL2 O-DICHLOROBENZENE 147.003 176.0924 -0.150366 4.36E-04
231 C6H4CL2 M-DICHLOROBENZENE 147.003 174.5062 -0.160392 4.70E-04
232 C6H4CL2 P-DICHLOROBENZENE 147.003 175.3994 -9.29E-02 2.33E-04
233 C6H4F2 M-DIFLUOROBENZENE 114.094 146.2047 -0.227601 6.42E-04
234 C6H4F2 O-DIFLUOROBENZENE 114.094 143.058 -0.208584 6.17E-04
235 C6H4F2 P-DIFLUOROBENZENE 114.094 149.0895 -0.242359 6.53E-04
236 C6H5BR BROMOBENZENE 157.009 158.5244 -0.144351 4.40E-04
237 C6H5CL CHLOROBENZENE 112.558 150.4141 -0.142546 4.64E-04
238 C6H5F FLUOROBENZENE 96.104 151.1213 -0.205386 6.31E-04
239 C6H5I IODOBENZENE 204.010 160.6757 -0.119998 3.73E-04
240 C6H6 BENZENE 78.113 155.6259 -0.271051 6.75E-04
241 C6H6O PHENOL 94.113 207.4793 -0.103749 2.74E-04
242 C6H6S BENZENETHIOL 110.173 182.678 -0.160403 4.62E-04
243 C6H7N 2-PICOLINE 93.128 153.402 -0.113465 4.27E-04
244 C6H7N 3-PICOLINE 93.128 165.9333 -0.173861 4.97E-04
245 C6H7N ANILINE 93.128 206.272 -0.211507 5.64E-04
246 C6H10 1-HEXYNE 82.145 166.3153 -0.111773 6.36E-04
247 C6H10 CYCLOHEXENE 82.145 133.8624 -0.105987 4.87E-04
248 C6H10 1-METHYLCYCLOPENTENE 82.145 130.3197 -8.92E-02 4.88E-04
251 C6H10O CYCLOHEXANONE 98.144
252 C6H12 1-HEXENE 84.161 157.713 -0.115777 6.79E-04
253 C6H12 2-HEXENE,CIS 84.161 166.9178 -0.114475 6.86E-04
254 C6H12 2-HEXENE,TRANS 84.161 167.786 -0.127277 7.07E-04
255 C6H12 3-HEXENE,CIS 84.161 165.421 -0.117915 6.87E-04
256 C6H12 3-HEXENE,TRANS 84.161 172.2807 -0.163916 7.68E-04
257 C6H12 2-METHYL-1-PENTENE 84.161 161.6497 -0.121605 6.94E-04
258 C6H12 3-METHYL-1-PENTENE 84.161 150.3967 -9.59E-02 6.50E-04
261 C6H12 3-METHYL-2-PENTENE,CIS 84.161 152.1068 -0.111704 6.33E-04
262 C6H12 3-METHYL-2-PENTENE,TRANS 84.161 151.5567 -0.105569 6.18E-04
263 C6H12 4-METHYL-2-PENTENE,CIS 84.161 156.0824 -0.1354 7.41E-04
264 C6H12 4-METHYL-2-PENTENE,TRANS 84.161 156.3821 -0.123496 7.22E-04
265 C6H12 2-ETHYL-1-BUTENE 84.161 165.1132 -0.129086 7.08E-04
266 C6H12 2,3-DIMETHYL-1-BUTENE 84.161 150.8481 -9.16E-02 6.47E-04
267 C6H12 3,3-DIMETHYL-1-BUTENE 84.161 147.298 -0.149003 7.19E-04
268 C6H12 2,3-DIMETHYL-2-BUTENE 84.161 191.5076 -0.238163 8.67E-04
269 C6H12 CYCLOHEXANE 84.161 178.9841 -0.321567 7.97E-04
270 C6H12 METHYLCYCLOPENTANE 84.161 137.2329 -8.29E-02 5.19E-04
271 C6H12O CYCLOHEXANOL 100.160
272 C6H12O HEXANAL 100.160 214.4491 -0.258752 8.34E-04
273 C6H12S THIACYCLOHEPTANE 116.220 202.7318 -0.219395 5.53E-04
274 C6H14 HEXANE 86.177 181.7722 -0.215501 8.76E-04
275 C6H14 2-METHYLPENTANE 86.177 162.646 -0.108721 7.21E-04
276 C6H14 3-METHYLPENTANE 86.177 169.6343 -0.15779 7.68E-04
277 C6H14 2,2-DIMETHYLBUTANE 86.177 167.8527 -0.200523 8.50E-04
278 C6H14 2,3-DIMETHYLBUTANE 86.177 160.7212 -0.139457 7.36E-04
279 C6H14O PROPYL-ETHER 102.176 192.8795 -0.157205 7.84E-04
280 C6H14O ISOPROPYL-ETHER 102.176 183.4485 -0.249749 9.41E-04
281 C6H14O HEXYL-ALCOHOL 102.176 240.2844 -0.273782 8.34E-04
282 C6H14S BUTYL-ETHYL-SULFIDE 118.236 219.6956 -0.167158 6.96E-04
283 C6H14S ISOPROPYL-SULFIDE 118.236 188.8548 -0.139208 6.22E-04
284 C6H14S METHYL-PENTYL-SULFIDE 118.236 200.4453 -0.158112 6.61E-04
285 C6H14S PROPYL-SULFIDE 118.236 209.7997 -0.147755 6.52E-04
286 C6H14S 1-HEXANETHIOL 118.236 234.4285 -0.182565 7.03E-04
287 C6H14S2 PROPYL-DISULFIDE 150.296 240.4063 -0.14485 5.88E-04
288 C6H15N TRIETHYLAMINE 101.191 188.3567 -0.161163 7.62E-04
289 C7H5F3 A,A,A-TRIFLUOROTOLUENE 146.111 148.1865 -0.206274 5.99E-04
290 C7H5N BENZONITRILE 103.123
291 C7H6O2 BENZOIC-ACID 122.123 282.6829 -0.18248 3.51E-04
292 C7H7F P-FLUOROTOLUENE 110.130 145.6576 -0.158125 5.28E-04
293 C7H8 TOLUENE 92.140 147.0419 -0.114054 4.90E-04
294 C7H8 1,3,5-CYCLOHEPTATRIENE 92.140 183.1835 -0.161546 6.23E-04
295 C7H8O M-CRESOL 108.139 250.4301 -0.295391 7.14E-04
296 C7H8O O-CRESOL 108.139 239.2767 -0.112153 3.08E-04
297 C7H8O P-CRESOL 108.139 233.8168 -0.109048 2.94E-04
298 C7H12 1-HEPTYNE 96.172 210.2149 -0.205483 7.91E-04
299 C7H14 1-HEPTENE 98.188 190.3995 -0.146978 7.28E-04
300 C7H14 CYCLOHEPTANE 98.188 227.5194 -0.306924 8.23E-04
301 C7H14 ETHYLCYCLOPENTANE 98.188 163.7651 -9.18E-02 5.49E-04
302 C7H14 1,1-DIMETHYLCYCLOPENTANE 98.188 180.7567 -0.204724 7.35E-04
303 C7H14 C-1,2-DIMETHYLCYCLOPENTANE 98.188 188.3135 -0.224256 7.39E-04
304 C7H14 T-1,2-DIMETHYLCYCLOPENTANE 98.188 169.3445 -0.126559 6.27E-04
305 C7H14 C-1,3-DIMETHYLCYCLOPENTANE 98.188 166.2584 -0.106134 6.03E-04
306 C7H14 T-1,3-DIMETHYLCYCLOPENTANE 98.188 166.397 -0.104868 5.98E-04
307 C7H14 METHYLCYCLOHEXANE 98.188 163.1495 -0.105482 5.65E-04
308 C7H14O HEPTANAL 114.187 246.725 -0.257434 7.97E-04
309 C7H16 HEPTANE 100.203 211.9577 -0.229934 9.03E-04
310 C7H16 2-METHYLHEXANE 100.203 198.0114 -0.175795 8.38E-04
311 C7H16 3-METHYLHEXANE 100.203 181.713 -8.48E-02 6.96E-04
312 C7H16 3-ETHYLPENTANE 100.203 197.1591 -0.15949 7.77E-04
313 C7H16 2,2-DIMETHYLPENTANE 100.203 195.8654 -0.167438 8.41E-04
317 C7H16 2,2,3-TRIMETHYLBUTANE 100.203 232.6126 -0.401595 1.12E-03
318 C7H16O ISOPROPYL-TERT-BUTYL-ETHER 116.202 218.4087 -0.209055 8.57E-04
319 C7H16O HEPTYL-ALCOHOL 116.202 240.5662 -0.268582 7.80E-04
320 C7H16S BUTYL-PROPYL-SULFIDE 132.263 263.2021 -0.215379 7.58E-04
321 C7H16S ETHYL-PENTYL-SULFIDE 132.263 264.0038 -0.232336 8.05E-04
322 C7H16S HEXYL-METHYL-SULFIDE 132.263 264.0038 -0.232336 8.05E-04
323 C7H16S 1-HEPTANETHIOL 132.263 281.2272 -0.272182 8.41E-04
324 C8H6 ETHYNYLBENZENE 102.135 183.3717 -0.168062 5.16E-04
325 C8H8 STYRENE 104.151 184.566 -0.214932 6.26E-04
326 C8H8 1,3,5,7-CYCLOOCTATETRAENE 104.151 236.5127 -0.270924 7.35E-04
327 C8H10 ETHYLBENZENE 106.167 172.1628 -0.121182 5.19E-04
328 C8H10 M-XYLENE 106.167 185.1319 -0.193865 6.18E-04
329 C8H10 O-XYLENE 106.167 196.5503 -0.221792 6.39E-04
330 C8H10 P-XYLENE 106.167 210.6075 -0.31537 7.63E-04
331 C8H14 1-OCTYNE 110.198 241.3442 -0.222052 8.38E-04
332 C8H16 1-OCTENE 112.214 222.6086 -0.173861 7.63E-04
333 C8H16 CYCLOOCTANE 112.214 277.9401 -0.352051 8.68E-04
334 C8H16 PROPYLCYCLOPENTANE 112.214 204.1291 -0.140074 6.75E-04
335 C8H16 ETHYLCYCLOHEXANE 112.214 206.7234 -0.129358 6.23E-04
336 C8H16 1,1-DIMETHYLCYCLOHEXANE 112.214 218.3105 -0.267156 7.96E-04
337 C8H16 C-1,2-DIMETHYLCYCLOHEXANE 112.214 223.4466 -0.230512 7.50E-04
338 C8H16 T-1,2-DIMETHYLCYCLOHEXANE 112.214 203.4328 -0.165023 6.69E-04
343 C8H16O OCTANAL 128.213 285.2043 -0.357029 9.94E-04
344 C8H18 OCTANE 114.230 256.3503 -0.322165 1.04E-03
345 C8H18 2-METHYLHEPTANE 114.230 230.5234 -0.196661 8.78E-04
348 C8H18 3-ETHYLHEXANE 114.230 224.2009 -0.175115 8.46E-04
349 C8H18 2,2-DIMETHYLHEXANE 114.230 211.1269 -0.165124 8.12E-04
355 C8H18 3-ETHYL-2-METHYLPENTANE 114.230 223.0395 -0.180747 8.40E-04
356 C8H18 3-ETHYL-3-METHYLPENTANE 114.230 234.234 -0.209413 8.44E-04
357 C8H18 2,2,3-TRIMETHYLPENTANE 114.230 217.7465 -0.182793 8.35E-04
361 C8H18 2,2,3,3-TETRAMETHYLBUTANE 114.230 236.6923 -0.185561 8.21E-04
362 C8H18O BUTYL-ETHER 130.229 257.0284 -0.226269 9.31E-04
363 C8H18O SEC-BUTYL-ETHER 130.229 233.6821 -0.207265 8.80E-04
364 C8H18O TERT-BUTYL-ETHER 130.229 232.3202 -0.282122 9.67E-04
365 C8H18O OCTYL-ALCOHOL 130.229 277.0928 -0.326062 8.68E-04
366 C8H18S BUTYL-SULFIDE 146.290 280.893 -0.241293 8.23E-04
367 C8H18S ETHYL-HEXYL-SULFIDE 146.290 298.6565 -0.257971 8.69E-04
368 C8H18S HEPTYL-METHYL-SULFIDE 146.290 298.6565 -0.257971 8.69E-04
369 C8H18S PENTYL-PROPYL-SULFIDE 146.290 298.6565 -0.257971 8.69E-04
370 C8H18S 1-OCTANETHIOL 146.290 309.9801 -0.275976 8.74E-04
371 C8H18S2 BUTY-DISULFIDE 178.350 302.417 -0.197227 7.16E-04
372 C9H10 ALPHA-METHYLSTYRENE 118.178 215.6436 -0.229765 6.53E-04
373 C9H10 PROPENYLBENZENE,CIS 118.178 208.9036 -0.168095 5.83E-04
374 C9H10 PROPENYLBENZENE,TRANS 118.178 219.3515 -0.217669 6.39E-04
375 C9H10 M-METHYLSTYRENE 118.178 199.8579 -0.140843 5.59E-04
376 C9H10 O-METHYLSTYRENE 118.178 208.6835 -0.166977 5.94E-04
377 C9H10 P-METHYLSTYRENE 118.178 217.1665 -0.219312 6.52E-04
378 C9H12 PROPYLBENZENE 120.193 200.0546 -0.128653 5.64E-04
379 C9H12 CUMENE 120.193 196.44 -0.135398 5.75E-04
380 C9H12 M-ETHYLTOLUENE 120.193 200.3633 -0.139135 5.84E-04
381 C9H12 O-ETHYLTOLUENE 120.193 208.9943 -0.153366 5.91E-04
382 C9H12 P-ETHYLTOLUENE 120.193 210.7694 -0.186222 6.38E-04
383 C9H12 1,2,3-TRIMETHYLBENZENE 120.193 225.0839 -0.228954 6.56E-04
384 C9H12 1,2,4-TRIMETHYLBENZENE 120.193 215.054 -0.20882 6.54E-04
385 C9H12 MESITYLENE 120.193 203.9968 -0.201648 6.29E-04
386 C9H16 1-NONYNE 124.225 285.1196 -0.305555 9.68E-04
387 C9H18 1-NONENE 126.241 271.8159 -0.234041 8.93E-04
388 C9H18 BUTYLCYCLOPENTANE 126.241 237.6627 -0.159621 7.21E-04
389 C9H18 PROPYLCYCLOHEXANE 126.241 242.0041 -0.170474 7.11E-04
390 C9H18 C-C-135TRIMETHYLCYCLOHEXANE 126.241 237.2095 -0.275445 8.63E-04
391 C9H18 C-T-135TRIMETHYLCYCLOHEXANE 126.241 226.1846 -0.214979 8.08E-04
392 C9H18O NONANAL 142.240 320.2875 -0.410958 1.05E-03
393 C9H20 NONANE 128.257 288.7963 -0.344804 1.08E-03
394 C9H20 2-METHYLOCTANE 128.257 269.0613 -0.272041 9.95E-04
397 C9H20 3-ETHYLHEPTANE 128.257 255.3025 -0.195268 8.92E-04
398 C9H20 4-ETHYLHEPTANE 128.257 253.1354 -0.194702 8.90E-04
399 C9H20 2,2-DIMETHYLHEPTANE 128.257 243.0672 -0.191036 8.75E-04
408 C9H20 3-ETHYL-2-METHYLHEXANE 128.257 249.5951 -0.195538 8.88E-04
412 C9H20 2,2,3-TRIMETHYLHEXANE 128.257 242.06 -0.171762 8.33E-04
420 C9H20 3,3-DIETHYLPENTANE 128.257 292.8768 -0.373551 1.08E-03
421 C9H20 3-ETHYL-2,2-DIMETHYLPENTANE 128.257 249.6552 -0.211837 8.84E-04
424 C9H20 2,2,3,3-TETRAMETHYLPENTANE 128.257 300.3904 -0.444003 1.16E-03
428 C9H20O NONYL-ALCOHOL 144.256 309.9229 -0.360723 9.20E-04
429 C9H20S BUTYL-PENTYL-SULFIDE 160.317 343.332 -0.327959 9.81E-04
430 C9H20S ETHYL-HEPTYL-SULFIDE 160.317 343.332 -0.327959 9.81E-04
431 C9H20S HEXYL-PROPYL-SULFIDE 160.317 343.332 -0.327959 9.81E-04
432 C9H20S METHYL-OCTYL-SULFIDE 160.317 343.332 -0.327959 9.81E-04
433 C9H20S 1-NONANETHIOL 160.317 356.912 -0.365687 9.98E-04
434 C10H8 NAPHTHALENE 128.173 226.6239 -0.104725 2.44E-04
435 C10H8 AZULENE 128.173 233.9236 -0.102644 4.58E-04
436 C10H14 BUTYLBENZENE 134.220 229.1261 -0.154935 6.20E-04
437 C10H14 M-DIETHYLBENZENE 134.220 229.3051 -0.161043 6.27E-04
438 C10H14 O-DIETHYLBENZENE 134.220 251.3948 -0.248511 7.26E-04
439 C10H14 P-DIETHYLBENZENE 134.220 248.6076 -0.24987 7.56E-04
440 C10H14 1,2,3,4-TETRAMETHYLBENZENE 134.220 257.5955 -0.29458 7.55E-04
443 C10H18 1-DECYNE 138.252 319.8947 -0.341526 1.04E-03
444 C10H18 DECAHYDRONAPHTHALENE,CIS 138.252 234.5421 -0.194409 6.09E-04
445 C10H18 DECAHYDRONAPHTHALENE,TRANS 138.252 239.2636 -0.222615 6.55E-04
446 C10H20 1-DECENE 140.268 293.7518 -0.259669 9.06E-04
447 C10H20 1-CYCLOPENTYLPENTANE 140.268 277.584 -0.219499 8.28E-04
448 C10H20 BUTYLCYCLOHEXANE 140.268 280.3501 -0.210028 7.73E-04
449 C10H20O DECANAL 156.267 353.0502 -0.450931 1.14E-03
450 C10H22 DECANE 142.283 335.151 -0.440914 1.23E-03
451 C10H22 2-METHYLNONANE 142.283 306.3252 -0.307405 1.08E-03
455 C10H22 3-ETHYLOCTANE 142.283 295.8119 -0.272159 1.03E-03
456 C10H22 4-ETHYLOCTANE 142.283 292.4179 -0.279331 1.05E-03
457 C10H22 2,2-DIMETHYLOCTANE 142.283 301.0542 -0.357918 1.12E-03
469 C10H22 4-PROPYLHEPTANE 142.283 303.3071 -0.378568 1.17E-03
470 C10H22 4-ISOPROPYLHEPTANE 142.283 304.7092 -0.371169 1.15E-03
471 C10H22 3-ETHYL-2-METHYLHEPTANE 142.283 307.322 -0.365994 1.14E-03
479 C10H22 2,2,3-TRIMETHYLHEPTANE 142.283 301.5056 -0.348037 1.09E-03
495 C10H22 3-ISOPROPYL-2-METHYLHEXANE 142.283 314.5248 -0.364355 1.13E-03
496 C10H22 3,3-DIETHYLHEXANE 142.283 313.2017 -0.351998 1.10E-03
497 C10H22 3,4-DIETHYLHEXANE 142.283 310.9031 -0.365131 1.14E-03
498 C10H22 3-ETHYL-2,2-DIMETHYLHEXANE 142.283 300.0603 -0.354135 1.11E-03
507 C10H22 2,2,3,3-TETRAMETHYLHEXANE 142.283 304.361 -0.337133 1.06E-03
517 C10H22 3,3,4,4-TETRAMETHYLHEXANE 142.283 341.01 -0.437119 0.0011503
518 C10H22 24DIMETHYL3ISOPROPYLPENTANE 142.283 286.5048 -0.275946 1.01E-03
519 C10H22 33-DIETHYL-2-METHYLPENTANE 142.283 302.4176 -0.262515 9.68E-04
520 C10H22 3ETHYL-223TRIMETHYLPENTANE 142.283 301.7797 -0.25175 9.37E-04
523 C10H22 22334-PENTAMETHYLPENTANE 142.283 319.5981 -0.355344 1.05E-03
524 C10H22 22344-PENTAMETHYLPENTANE 142.283 311.5505 -0.37509 1.10E-03
525 C10H22O DECYL-ALCOHOL 158.283 346.4964 -0.419902 1.01E-03
526 C10H22S BUTYL-HEXYL-SULFIDE 174.343 382.1494 -0.369325 1.06E-03
527 C10H22S ETHYL-OCTYL-SULFIDE 174.343 382.1494 -0.369325 1.06E-03
528 C10H22S HEPTYL-PROPYL-SULFIDE 174.343 382.1494 -0.369325 1.06E-03
529 C10H22S METHYL-NONYL-SULFIDE 174.343 382.1494 -0.369325 1.06E-03
530 C10H22S PENTYL-SULFIDE 174.343 382.1494 -0.369325 1.06E-03
531 C10H22S 1-DECANETHIOL 174.343 384.7547 -0.372938 1.04E-03
532 C10H22S2 PENTYL-DISULFIDE 206.403 358.9367 -0.251922 8.41E-04
533 C11H10 1-METHYLNAPHTHALENE 142.200 257.7842 -0.200341 5.84E-04
534 C11H10 2-METHYLNAPHTHALENE 142.200 232.7541 -7.84E-02 2.24E-04
535 C11H16 PENTYLBENZENE 148.247 265.7557 -0.187731 6.90E-04
536 C11H16 PENTAMETHYLBENZENE 148.247 326.4048 -0.179938 4.33E-04
537 C11H20 1-UNDECYNE 152.279 362.3009 -0.419214 1.16E-03
538 C11H22 1-UNDECENE 154.294 336.1205 -0.373825 1.14E-03
539 C11H22 1-CYCLOPENTYLHEXANE 154.294 313.3215 -0.258755 9.10E-04
540 C11H22 PENTYLCYCLOHEXANE 154.294 321.248 -0.286531 9.29E-04
541 C11H24 UNDECANE 156.310 369.5517 -0.467339 1.27E-03
542 C11H24O UNDECYL-ALCOHOL 172.310 380.6341 -0.52568 1.20E-03
543 C11H24S BUTYL-HEPTYL-SULFIDE 188.370 427.0825 -0.444553 1.18E-03
544 C11H24S DECYL-METHYL-SULFIDE 188.370 427.0825 -0.444553 1.18E-03
545 C11H24S ETHYL-NONYL-SULFIDE 188.370 427.0825 -0.444553 1.18E-03
546 C11H24S OCTYL-PROPYL-SULFIDE 188.370 427.0825 -0.444553 1.18E-03
547 C11H24S 1-UNDECANETHIOL 188.370 431.9615 -0.469362 1.17E-03
548 C12H10 BIPHENYL 154.211 251.4985 -8.35E-02 2.12E-04
549 C12H12 1-ETHYLNAPHTHALENE 156.226 284.5099 -0.221362 6.07E-04
550 C12H12 2-ETHYLNAPHTHALENE 156.226 286.838 -0.230201 6.14E-04
551 C12H12 1,2-DIMETHYLNAPHTHALENE 156.226 305.5508 -0.269947 6.87E-04
560 C12H18 HEXYLBENZENE 162.274 300.9906 -0.222058 7.53E-04
561 C12H18 1,2,3-TRIETHYLBENZENE 162.274 287.3836 -0.230458 7.87E-04
564 C12H18 HEXAMETHYLBENZENE 162.274 404.3094 -0.361645 5.97E-04
565 C12H22 1-DODECYNE 166.305 397.674 -0.463689 1.24E-03
566 C12H24 1-DODECENE 168.321 380.2977 -0.44339 1.25E-03
567 C12H24 1-CYCLOPENTYLHEPTANE 168.321 355.0891 -0.334337 1.04E-03
568 C12H24 1-CYCLOHEXYLHEXANE 168.321 382.7536 -0.442261 1.13E-03
569 C12H26 DODECANE 170.337 414.3532 -0.54085 1.37E-03
570 C12H26O DODECYL-ALCOHOL 186.336 418.3394 -0.597346 1.33E-03
571 C12H26S BUTYL-OCTYL-SULFIDE 202.397 464.1272 -0.486011 1.25E-03
572 C12H26S DECYL-ETHYL-SULFIDE 202.397 464.1272 -0.486011 1.25E-03
573 C12H26S HEXYL-SULFIDE 202.397 464.1272 -0.486011 1.25E-03
574 C12H26S METHYL-UNDECYL-SULFIDE 202.397 464.1272 -0.486011 1.25E-03
575 C12H26S NONYL-PROPYL-SULFIDE 202.397 464.1272 -0.486011 1.25E-03
576 C12H26S 1-DODECANETHIOL 202.397 458.3501 -0.476471 1.21E-03
577 C12H26S2 HEXYL-DISULFIDE 234.457 414.7588 -0.311169 9.70E-04
578 C13H14 1-PROPYLNAPHTHALENE 170.253 313.4827 -0.264764 6.96E-04
579 C13H14 2-PROPYLNAPHTHALENE 170.253 317.1675 -0.27519 7.06E-04
580 C13H14 2ETHYL-3-METHYLNAPHTHALENE 170.253 313.8667 -0.142952 3.34E-04
583 C13H20 1-PHENYLHEPTANE 176.301 338.1881 -0.272394 8.50E-04
584 C13H24 1-TRIDECYNE 180.332 440.4068 -0.541833 1.35E-03
585 C13H26 1-TRIDECENE 182.348 434.5519 -0.528565 1.41E-03
586 C13H26 1-CYCLOPENTYLOCTANE 182.348 391.1118 -0.371506 1.10E-03
587 C13H26 1-CYCLOHEXYLHEPTANE 182.348 401.4602 -0.404172 1.13E-03
588 C13H28 TRIDECANE 184.364 448.7255 -0.55754 1.39E-03
589 C13H28O 1-TRIDECANOL 200.363 392.8878 -0.201121 5.26E-04
590 C13H28S BUTYL-NONYL-SULFIDE 216.424 507.61 -0.555117 1.36E-03
591 C13H28S DECYL-PROPYL-SULFIDE 216.424 507.61 -0.555117 1.36E-03
592 C13H28S DODECYL-METHYL-SULFIDE 216.424 507.61 -0.555117 1.36E-03
593 C13H28S ETHYL-UNDECYL-SULFIDE 216.424 507.61 -0.555117 1.36E-03
594 C13H28S 1-TRIDECANETHIOL 216.424 502.9234 -0.563385 1.33E-03
595 C14H16 1-BUTYLNAPHTHALENE 184.280 338.1091 -0.266521 7.31E-04
596 C14H16 2-BUTYLNAPHTHALENE 184.280 344.5364 -0.295299 7.58E-04
597 C14H22 1-PHENYLOCTANE 190.327 373.6904 -0.309289 9.11E-04
598 C14H22 1,2,3,4-TETRAETHYLBENZENE 190.327 445.3734 -0.559407 1.30E-03
601 C14H26 1-TETRADECYNE 194.359 475.7809 -0.586739 1.43E-03
602 C14H28 1-TETRADECENE 196.375 474.684 -0.594961 1.51E-03
603 C14H28 1-CYCLOPENTYLNONANE 196.375 432.1424 -0.440174 1.21E-03
604 C14H28 1-CYCLOHEXYLOCTANE 196.375 441.0957 -0.462991 1.22E-03
605 C14H30 TETRADECANE 198.391 493.4119 -0.625994 1.49E-03
606 C14H30O 1-TETRADECANOL 214.390 377.8381 -0.22051 5.48E-04
607 C14H30S BUTYL-DECYL-SULFIDE 230.451 545.1466 -0.601768 1.44E-03
608 C14H30S DODECYL-ETHYL-SULFIDE 230.451 545.1466 -0.601768 1.44E-03
609 C14H30S HEPTYL-SULFIDE 230.451 545.1466 -0.601768 1.44E-03
610 C14H30S METHYL-TRIDECYL-SULFIDE 230.451 545.1466 -0.601768 1.44E-03
611 C14H30S PROPYL-UNDECYL-SULFIDE 230.451 545.1466 -0.601768 1.44E-03
612 C14H30S 1-TETRADECANETHIOL 230.451 530.2379 -0.581774 1.38E-03
613 C14H30S2 HEPTYL-DISULFIDE 262.511 470.6042 -0.377799 1.11E-03
614 C15H18 1-PENTYLNAPHTHALENE 198.307 369.3459 -0.286385 7.87E-04
615 C15H18 2-PENTYLNAPHTHALENE 198.307 384.5773 -0.328525 8.33E-04
616 C15H24 1-PHENYLNONANE 204.354 409.8604 -0.349193 9.73E-04
617 C15H28 1-PENTADECYNE 208.386 514.7604 -0.656781 1.53E-03
618 C15H30 1-PENTADECENE 210.402 514.1969 -0.659584 1.61E-03
619 C15H30 1-CYCLOPENTYLDECANE 210.402 467.7266 -0.4871 1.29E-03
620 C15H30 1-CYCLOHEXYLNONANE 210.402 480.8706 -0.522321 1.32E-03
621 C15H32 PENTADECANE 212.417 529.9458 -0.650491 1.52E-03
622 C15H32O 1-PENTADECANOL 228.417 449.1265 -0.235248 5.84E-04
623 C15H32S BUTYL-UNDECYL-SULFIDE 244.477 585.9476 -0.665038 1.53E-03
624 C15H32S DODECYL-PROPYL-SULFIDE 244.477 585.9476 -0.665038 1.53E-03
625 C15H32S ETHYL-TRIDECYL-SULFIDE 244.477 585.9476 -0.665038 1.53E-03
626 C15H32S METHYL-TETRADECYL-SULFIDE 244.477 585.9476 -0.665038 1.53E-03
627 C15H32S 1-PENTADECANETHIOL 244.477 571.5035 -0.659117 1.49E-03
628 C16H26 1-PHENYLDECANE 218.381 443.2645 -0.383389 1.03E-03
629 C16H26 PENTAETHYLBENZENE 218.381 456.0537 -0.260623 6.14E-04
630 C16H30 1-HEXADECYNE 222.413 550.396 -0.708033 1.61E-03
631 C16H32 1-HEXADECENE 224.428 550.8728 -0.723346 1.70E-03
632 C16H32 1-CYCLOPENTYLUNDECANE 224.428 508.3097 -0.558501 1.40E-03
633 C16H32 1-CYCLOHEXYLDECANE 224.428 519.0087 -0.582482 1.41E-03
634 C16H34 HEXADECANE 226.444 573.1349 -0.707507 1.60E-03
635 C16H34O 1-HEXADECANOL 242.444 521.5002 -0.251994 6.21E-04
636 C16H34S BUTYL-DODECYL-SULFIDE 258.504 622.149 -0.713599 1.61E-03
637 C16H34S ETHYL-TETRADECYL-SULFIDE 258.504 633.8104 -0.791403 1.75E-03
638 C16H34S METHYL-PENTADECYL-SULFIDE 258.504 622.149 -0.713599 1.61E-03
639 C16H34S OCTYL-SULFIDE 258.504 622.149 -0.713599 1.61E-03
640 C16H34S PROPYL-TRIDECYL-SULFIDE 258.504 622.149 -0.713599 1.61E-03
641 C16H34S 1-HEXADECANETHIOL 258.504 599.5524 -0.689216 1.55E-03
642 C16H34S2 OCTYL-DISULFIDE 290.564 526.8982 -0.4512 1.25E-03
643 C17H28 1-PHENYLUNDECANE 232.408 479.7076 -0.442282 1.13E-03
644 C17H32 1-HEPTADECYNE 236.439 588.957 -0.776666 1.71E-03
645 C17H34 1-HEPTADECENE 238.455 589.8775 -0.77262 1.77E-03
646 C17H34 1-CYCLOPENTYLDODECANE 238.455 542.5786 -0.605798 1.48E-03
647 C17H34 1-CYCLOHEXYLUNDECANE 238.455 556.6256 -0.639949 1.50E-03
648 C17H36 HEPTADECANE 240.471 598.2518 -0.743507 1.65E-03
649 C17H36O 1-HEPTADECANOL 256.470 486.9349 -0.268976 6.39E-04
650 C17H36S BUTYL-TRIDECYL-SULFIDE 272.531 660.6669 -0.775948 0.001705
651 C17H36S ETHYL-PENTADECYL-SULFIDE 272.531 660.6669 -0.775948 0.001705
652 C17H36S HEXADECYL-METHYL-SULFIDE 272.531 660.6669 -0.775948 0.001705
653 C17H36S PROPYL-TETRADECYL-SULFIDE 272.531 660.6669 -0.775948 0.001705
654 C17H36S 1-HEPTADECANETHIOL 272.531 568.3615 -0.225104 6.21E-04
655 C18H30 1-PHENYLDODECANE 246.435 512.2522 -0.476222 1.18E-03
656 C18H30 HEXAETHYLBENZENE 246.435 523.5062 -0.453371 8.10E-04
657 C18H34 1-OCTADECYNE 250.466 546.7927 -0.250831 6.75E-04
658 C18H36 1-OCTADECENE 252.482 631.3307 -0.864916 1.92E-03
659 C18H36 1-CYCOPENTYLTRIDECANE 252.482 582.0896 -0.675296 1.58E-03
660 C18H36 1-CYCLOHEXYLDODECANE 252.482 594.223 -0.701574 1.60E-03
661 C18H38 OCTADECANE 254.498 561.469 -0.273091 7.24E-04
662 C18H38O 1-OCTADECANOL 270.497 508.95 -0.284541 6.64E-04
663 C18H38S BUTYL-TETRADECYL-SULFIDE 286.558 697.6482 -0.827127 1.78E-03
664 C18H38S ETHYL-HEXADECYL-SULFIDE 286.558 697.6482 -0.827127 1.78E-03
665 C18H38S HEPTADECYL-METHYL-SULFIDE 286.558 697.6482 -0.827127 1.78E-03
666 C18H38S NONYL-SULFIDE 286.558 697.6482 -0.827127 1.78E-03
667 C18H38S PENTADECYL-PROPYL-SULFIDE 286.558 697.6482 -0.827127 1.78E-03
668 C18H38S 1-OCTADECANETHIOL 286.558 591.688 -0.23207 6.39E-04
669 C18H38S2 NONYL-DISULFIDE 318.618 581.9699 -0.526118 1.38E-03
670 C19H32 1-PHENYLTRIDECANE 260.461 543.6499 -0.507299 1.22E-03
671 C19H36 1-NONADECYNE 264.493 573.7683 -0.268047 7.03E-04
672 C19H38 1-NONADECENE 266.509 664.7043 -0.897628 1.95E-03
673 C19H38 1-CYCLOPENTYLTETRADECANE 266.509 613.417 -0.715 1.65E-03
674 C19H38 1-CYCLOHEXYLTRIDECANE 266.509 630.4597 -0.758542 1.68E-03
675 C19H40 NONADECANE 268.525 583.0633 -0.24104 6.47E-04
676 C19H40O 1-NONADECANOL 284.524 553.437 -0.295932 6.85E-04
677 C19H40S BUTYL-PENTADECYL-SULFIDE 300.585 644.5607 -0.25109 6.84E-04
678 C19H40S ETHYL-HEPTADECYL-SULFIDE 300.585 644.5607 -0.25109 6.84E-04
679 C19H40S HEXADECYL-PROPYL-SULFIDE 300.585 644.5607 -0.25109 6.84E-04
680 C19H40S METHYL-OCTADECYL-SULFIDE 300.585 644.5607 -0.25109 6.84E-04
681 C19H40S 1-NONADECANETHIOL 300.585 616.9435 -0.250083 6.69E-04
682 C20H34 1-PHENYLTETRADECANE 274.488 573.7506 -0.537621 1.27E-03
683 C20H38 1-EICOSYNE 278.520 599.0401 -0.281178 7.28E-04
684 C20H40 1-EICOSENE 280.536 608.4817 -0.284044 7.56E-04
685 C20H40 1-CYCLOPENTYLPENTADECANE 280.536 655.4908 -0.814904 1.81E-03
686 C20H40 1-CYCLOHEXYLTETRADECANE 280.536 665.3303 -0.817215 1.77E-03
687 C20H42 EICOSANE 282.551 615.931 -0.310825 7.91E-04
688 C20H42O 1-EICOSANOL 298.551 551.8545 -0.311972 7.06E-04
689 C20H42S BUTYL-HEXADECYL-SULFIDE 314.611 670.8407 -0.268678 7.12E-04
690 C20H42S DECYL-SULFIDE 314.611 670.8407 -0.268678 7.12E-04
691 C20H42S ETHYL-OCTADECYL-SULFIDE 314.611 670.8407 -0.268678 7.12E-04
692 C20H42S HEPTADECYL-PROPYL-SULFIDE 314.611 670.8407 -0.268678 7.12E-04
693 C20H42S METHYL-NONADECYL-SULFIDE 314.611 670.8407 -0.268678 7.12E-04
694 C20H42S 1-EICOSANETHIOL 314.611 640.1282 -0.263151 6.92E-04
695 C20H42S2 DECYL-DISULFIDE 346.671 636.7532 -0.609965 1.53E-03
696 C21H36 1-PHENYLPENTADECANE 288.515 607.8745 -0.60106 1.37E-03
697 C21H42 1-CYCLOPENTYLHEXADECANE 294.562 686.8347 -0.848133 1.84E-03
698 C21H42 1-CYCLOHEXYLPENTADECANE 294.562 614.2168 -0.251495 6.82E-04
699 C22H38 1-PHENYLHEXADECANE 302.542 579.507 -0.187461 5.38E-04
700 C22H44 1-CYCLOHEXYLHEXADECANE 308.589 639.5113 -0.267177 7.09E-04
H2O
T= 364
T= 637.15 oK
T1= 298 oK 339.15
Comp. H2O H2 CH4 C2H6
e temperatura Cp (Kcal/KmoloC) 8.3 6.97 10.6 14.2
e No. de Sustancia (25-364)
18.103598 7.012926 5.3642238 5.580758
Tmax Teb
-131.53 -161.75 C T= 298.15
Comp. H2O H2 CH4 C2H6

Cp (Kcal/KmoloC) 8.96 7.02 13.48 0
(25-794)
17.296819 6.9329927 4.9150488 4.862078
TX
TN (Tmin)
(Tmax) Teb [K]
[K]
[K] T= 1067
250.00 379.84 349.80
162.00 327.10 Comp. H2O H2 CH4 C2H6
115.40 273.29 Cp (Kcal/KmoloC) 8.96 7.02 13.48 0
92.00 221.70 (25-794)
86.40 175.15 18.501592 7.3258262 5.933775 6.49204
68.10 111.61 81.70
216.56 258.57
134.30 252.91
161.30 349.00 319.40
209.60 364.33 334.30
138.00 312.07
113.00 262.38
110.00 221.00
396.16 521.16
178.10 343.15 312.90

140.16 294.06
101.71 251.49
279.26 485.16
156.00 279.55 254.10
281.50 403.92
179.50 307.50
175.40 279.15
131.40 224.79
206.70 345.58
244.60 403.99 374.40
90.70 141.62 111.40

175.50 367.77 337.90
150.00 309.10
179.70 296.76 266.80
251.00 424.22
238.20 350.75
179.00 307.30
172.40 224.90
186.80 391.15
244.00 463.47
94.53 251.01
189.40
155.92 334.71
192.70 363.45
223.00 351.50
237.00 449.15
129.00 217.46
107.90 277.86
107.90 277.86
133.66 318.96
119.40 289.40
235.80 416.55
160.20 353.90
130.00 231.02
161.90 255.74
229.30 382.75 354.80
104.00 199.39 169.40
283.30 434.64
176.20 360.65
237.50 387.14
156.20 277.15
356.16 503.16
161.00 313.81
150.20 323.75 294.00
289.80 421.29 391.10
165.37 358.07
154.60 341.73
136.80 315.50
129.90 265.45
165.00 375.59
195.16 358.55
89.90 214.63 184.60

131.70 279.16
159.10 381.45 351.40
260.20 500.49 470.50
174.90 340.66
125.30 338.73
188.44 412.89
192.00 319.79 289.70
181.00 310.09
189.50 380.50
136.90 271.15
170.50 279.75
285.00 444.00
153.76 373.16
138.70 348.38
258.50 459.00
173.86 405.16
180.30 400.30
87.90 255.65
145.70 270.29
217.96 443.16
172.70 399.50
173.66 423.56
239.36 372.46
253.16 530.16
161.00 337.25
144.00 399.65
193.00 351.95
178.20 359.35 329.40
199.96 398.13
163.16 374.16
184.16 362.56
150.40 349.73
156.00 337.95
114.16 299.95
139.80 293.81
172.16 405.56
183.06 392.56
85.50 261.14 231.10

134.00 310.76
146.90 400.40
184.70 385.45
167.20 370.15
159.98 369.15
142.62 355.70
190.00 352.15
156.00 306.02
232.16 297.16
187.50 334.50
234.90 387.01
137.00 314.00
164.20 298.74 268.70
147.40 311.21
240.90 330.13
153.76 305.75
199.00 439.55
161.00 420.37
201.66 406.96
87.80 296.92 266.90
134.30 306.88 276.90
167.60 304.03 274.00
132.80 296.29
182.40 315.66
207.76 469.46
238.66 464.16
279.06 506.76
176.80 377.93
186.50 382.64
189.60 379.84 350.20

177.00 424.60
160.76 404.76
161.26 394.36
256.96 376.41
150.10 381.60
141.80 371.15
142.86 372.16
247.80 353.91
234.96 403.16
213.16 388.95
134.80 302.98 272.70

113.60 291.52 261.40
156.90 337.65 307.60
156.87 341.72
156.87 333.92
165.20 420.61
158.50 402.80
298.80 385.88
169.20 395.26
171.65 387.90
160.19 398.71
157.48 401.61
133.02 388.13
128.30 391.64
274.27 367.36
171.70 456.67
224.10 380.12
188.00 366.15
201.16 346.91
223.40 359.16
231.50 418.38
209.77 415.71
204.18 418.60
135.90 348.00
185.70 345.10
185.69 347.22
124.90 329.10
147.51 351.41
159.50 344.00
127.20 337.22
167.50 343.35
163.86 359.22
183.46 329.50
138.10 347.38
166.11 342.19
107.90 335.81
121.70 339.25
132.90 339.50
135.60 334.28
104.70 323.25
139.30 341.70
179.30 352.41 322.40
288.00 474.01
182.00 406.00
196.00 405.41
292.14 444.90
155.39 435.33
185.26 432.74
174.16 410.15
168.76 401.66
199.66 388.76
143.40 339.22 309.20
113.30 331.15
256.60 312.64
164.56 358.30 328.40
195.00 440.90
327.00 416.30
175.33 426.58
156.15 421.65
169.38 402.28
197.45 429.80
256.10 479.10
248.46 476.16
326.26 477.16
249.16 393.66
239.16 394.66
260.16 392.00
242.30 459.10
227.60 435.06
234.00 388.05
241.80 491.57
278.70 383.31 353.20
314.00 484.89
258.37 472.32
207.00 432.56
254.86 447.30
267.00 487.20
141.26 374.49
169.70 386.14 356.10
145.96 378.95
130.16 373.16
112.31 378.31
133.30 367.91 336.30

132.00 372.00
140.00 371.00
135.30 369.60
159.70 370.30
137.44 365.27
120.16 357.34
119.53 357.03
138.10 370.50
138.30 370.90
134.70 373.60
139.00 359.60
132.00 361.70
141.63 367.84
115.90 358.80
158.00 344.40
198.90 376.40
279.60 383.90 353.90
130.70 374.97 345.00
217.16 431.43
292.14 444.90
177.80 371.93 341.90
119.50 363.40
155.00 366.35
173.30 352.87
144.60 361.16
151.00 393.20
187.70 371.40
229.20 460.25
178.03 447.41
170.45 423.19
179.16 431.16
170.45 446.00
192.66 455.84
187.68 494.65
158.40 392.35
244.06 405.16
395.60 553.00
216.36 419.76
178.00 413.73 383.80
193.66 418.65
285.40 505.40
304.10 494.08
307.90 504.98
192.26 402.86
154.30 396.79
265.00 421.94
134.70 406.60
203.40 391.00
219.30 402.68
155.60 395.01
139.46 393.92
139.19 394.87
146.60 404.08 374.10
229.86 455.00
182.60 401.56 371.60
154.90 393.19
100.00 394.98
154.60 396.57
149.40 382.35
149.40 393.05
154.00 383.77
138.70 389.22
248.30 384.03
177.80 408.66
239.20 479.07
206.66 474.16
206.66 474.16
206.66 474.16
229.91 480.11
242.53 448.36
242.50 448.15 418.30
266.16 443.16
178.20 439.17 409.40
225.30 442.22 412.30
248.00 447.46 417.60
286.40 441.44 411.50
193.86 429.36
171.40 425.17
287.60 454.30
155.80 434.10
161.80 434.94
239.70 422.70
223.10 432.94
185.00 426.71
197.60 423.25
183.00 427.60
185.70 427.56
236.20 422.50
245.93 474.87
216.40 428.77 398.80
164.00 420.80 372.40
152.70 422.07
152.20 420.92
152.16 421.70
152.00 410.01
171.96 418.78
171.96 412.82
181.90 411.76
147.00 415.12
147.06 421.85
158.20 418.81
182.30 421.42
160.90 413.25
165.80 402.38
172.50 417.89
163.90 416.58
172.47 409.60
175.00 442.85
171.65 424.20
206.49 410.37
257.70 498.26
209.86 485.15
209.86 498.16
209.86 498.16
209.86 498.16
223.93 502.30
202.16 534.36
249.93 468.50
211.47 473.16
243.82 473.16
186.81 471.16
204.58 474.16
239.00 472.16
173.70 460.17
177.10 456.31 425.60
177.60 464.50
192.30 468.30
210.80 465.20
247.70 479.27
227.00 472.26
228.40 467.89
223.16 453.96
191.80 450.00
165.18 459.76
178.70 459.90
223.46 441.66
188.76 443.70
267.30 491.60
219.70 453.81 424.00
192.80 446.19
165.56 447.37
159.96 445.58
159.96 446.16
159.96 444.36
160.00 435.85
160.16 443.66
160.16 436.05
160.16 439.16
170.26 438.37
170.26 440.17
170.26 443.76
170.26 439.16
170.26 438.36
160.16 441.16
160.16 436.96
160.16 443.76
160.16 443.56
153.16 436.75
153.00 429.69
167.40 427.24
156.36 440.84
156.36 442.20
145.36 434.50
159.78 433.81
171.96 443.62
240.10 449.30
173.67 436.99
173.67 447.86
150.80 439.85
263.00 443.44
152.00 436.18
206.00 425.44
171.10 444.72
268.00 516.61
231.16 521.16
231.16 521.16
231.16 521.16
231.16 521.16
253.04 522.96
353.45 521.13
173.66 545.16
185.20 486.43
189.24 484.25
241.92 487.02
231.00 486.94
266.91 508.25
249.00 501.25
352.00 500.00
229.16 477.16
230.00 498.61
242.80 490.42
206.90 473.70
190.16 483.76
198.40 484.10
268.16 511.66
243.50 476.86 447.30
198.51 470.16
188.36 470.96
174.46 468.86
185.46 468.26
185.46 469.66
185.46 466.80
219.16 460.06
219.16 467.47
219.16 459.06
219.16 461.66
219.16 463.54
219.16 463.03
219.16 464.36
219.16 466.56
219.16 462.56
219.16 463.96
219.16 460.66
219.16 465.29
219.16 460.66
219.16 462.06
219.16 464.36
219.16 459.36
219.16 462.86
219.16 466.96
219.16 465.36
219.16 461.36
219.16 466.16
219.16 463.96
219.16 460.76
219.16 451.46
219.16 453.96
219.16 452.09
219.16 463.36
219.16 463.06
219.16 463.86
219.16 459.16
219.16 454.16
219.16 459.66
219.16 450.76
219.16 455.96
219.16 465.06
219.16 458.85
219.16 464.26
219.16 465.66
219.16 469.86
219.16 469.46
219.16 467.06
219.16 459.26
219.16 450.16
219.16 466.86
219.16 464.06
219.16 463.26
219.16 464.26
219.16 457.26
219.16 466.06
219.16 465.26
219.16 463.48
219.16 461.96
219.16 451.56
219.16 456.96
219.16 451.04
260.56 440.63
260.56 467.75
260.56 456.26
260.56 464.76
260.56 459.36
260.56 473.16
191.46 460.20
191.46 472.86
191.46 472.66
191.46 458.46
191.46 472.60
236.71 469.21
234.41 462.45
280.10 534.12
238.16 543.16
238.16 543.16
238.16 543.16
238.16 543.16
238.16 543.16
247.59 542.36
214.16 567.06
242.70 547.82
307.70 544.22
198.16 508.62
327.50 535.05
248.16 498.16
224.00 495.80
200.16 506.26
215.66 506.87
247.60 498.70
292.16 546.16
254.66 563.16
254.66 563.16
254.66 563.16
254.66 563.16
270.37 560.56
342.40 558.15 528.20
259.35 561.49
265.76 561.49
272.16 569.46
269.16 568.36
280.82 570.46
355.16 568.16
259.16 566.16
260.16 566.16
378.16 571.16
385.16 565.16
371.16 566.16
212.16 529.26
206.66 520.66
206.66 520.66
206.66 519.16
438.66 566.60
254.16 518.16
238.00 516.50
220.00 527.30
263.60 527.86
263.60 518.61
297.10 563.10
259.16 582.16
259.16 582.16
259.16 582.16
259.16 582.16
259.16 582.16
265.37 577.76
225.16 596.66
264.69 575.96
270.16 576.66
344.16 580.16
318.16 573.16
318.16 573.16
225.16 549.16
268.16 537.16
250.10 535.90
229.16 546.86
242.66 548.06
267.80 537.77
304.16 577.16
271.16 600.16
271.16 600.16
271.16 600.16
271.16 600.16
282.04 593.96
253.44 592.55
268.16 592.16
237.16 567.56
284.96 554.16
284.16 553.66
283.16 553.16
273.16 555.16
260.30 554.30
244.16 565.26
253.46 566.76
279.02 556.14
312.66 566.36
276.16 617.16
276.16 617.16
276.16 617.16
276.16 617.16
276.16 617.16
279.26 609.36
235.16 623.86
251.16 610.16
269.16 613.16
249.16 585.16
283.16 571.16
269.40 571.50
251.03 582.54
262.96 584.66
283.08 573.59
317.04 608.01
284.16 633.16
284.16 633.16
284.16 633.16
284.16 633.16
290.93 623.86
258.78 601.05
327.66 580.16
288.16 587.16
277.30 588.00
263.16 598.76
271.43 600.82
291.00 590.50
322.46 647.16
288.16 648.16
288.16 648.16
288.16 648.16
288.16 648.16
288.16 648.16
290.93 637.16
244.16 649.16
268.16 616.36
295.16 602.16
284.36 603.22
268.16 614.06
278.96 616.26
295.00 606.00
327.00 625.60
294.16 662.16
294.16 662.16
294.16 662.16
294.16 662.16
300.37 651.16
276.16 630.76
401.16 601.16
300.16 616.16
290.80 618.00
278.16 628.56
285.66 630.86
301.30 619.50
331.00 634.95
298.16 676.16
298.16 676.16
298.16 676.16
298.16 676.16
298.16 676.16
300.93 663.16
252.16 672.16
283.16 644.36
306.16 630.16
296.56 631.66
282.00 642.16
291.66 644.66
305.00 633.15
334.87 659.01
303.16 689.16
303.16 689.16
303.16 689.16
303.16 689.16
307.04 675.16
289.16 657.16
309.16 643.16
301.76 644.86
290.00 655.00
297.16 657.16
310.00 647.00
339.00 654.50
308.16 701.16
308.16 701.16
308.16 701.16
308.16 701.16
308.16 701.16
310.37 686.16
259.16 693.16
295.16 669.16
294.16 667.16
302.16 670.16
300.16 681.16
306.76 682.16
ejercicio MIR
T2 = 300 oK
T1 = 200 oK
C3H8 C4H10 N2 CO CO2
17.4 20 7.06 A B C
24.8 0.0375 -0.00000736
13.072882 41.709086 7.322746 7.4007226 11.595226
33.708867 J/mol oK

0 0 7.37 7.44 11.53
5.5398682 24.07096 7.0240429 7.0344606 9.0140409

0 0 7.37 7.44 11.53
28.441326 56.770293 7.9756421 8.0347688 13.18749

Comp. H2O H2 CH4 C2H6 C3H8 C4H10 N2 CO CO2
H (Kcal/Kmol) -49380 0 -17890 -20240 -24820 -28500 0 -26420 -94050
Cp (Kcal/KmoloC) 8.3 6.97 10.6 14.2 17.4 20 7.06
(25-364)
Cp (Kcal/KmoloC) 8.96 7.02 13.48 0 0 0 7.37 7.44 11.53
(25-794)
Formula Integral T2 = 637 T2 = 1067

T1 = 298 T1 = 298
_(,2)=19,844,5/+4,17/ _(,2)=19,8+44,5/2
+4,17xln() 4.86432 4.84511
_(,2)=5,76+1,04/1000 +14,9/ _(,2)=5,76+1,04/21000
^214,9/2 6.07091 6.32058
_(,4)=4,52+0,01325 _(,4)=4,52+ 0,01325/2
^2 10.7144 13.5631
_(,26)=4,01+0,02943 _(,26)=4,01+0,02943/2 ^2
17.7685 24.096
_(,38)=2,258+0,0576/2
_(,38)=2,258+0,057617,6 10 ^2(17,6 10 ^(6) ^3)/3 25.1709 32.5045
^(6) ^2
_(,410)= 4,36+0,0727/2
_(,410)=4,36+0,072722,1 10 33.3055 42.5943
^2(22,1 10 ^(6) ^3)/3
^(6) ^2
_(,2)=9,47(1,93
10 ^3)/+(0 _(,2)=9,471,93
10 ^3
,358
10 ^6)/^2 (20,358
10 ^6)/^3 5.14507 6.26881
_(,)=9,46(1,93
10 ^3)/+(0, _(,)=9,461,93
10 ^3
33
10 ^6)/^2 (20,33
10 ^6)/^3 5.15386 6.27268
_(,2)=16,2(3,63
10 ^3)/+(0 _(,2)=16,23,63
10 ^3
435
10 ^6)/^2 (20,435
10 ^6)/^3 8.0655 10.1791
300 8.495
300 17.954
N2 NH3 H2
Pred 11.9269777 3.59375859 31.2599681
Tred 5.94007128 1.84939107 22.5488559
Fug 1.1 0.92 1.6
En un horno de "reforming" que dispone de 226 tubos de 130 mm de dimetro y 12,3 m de
longitud se procesan 16000Nm3/H de un gas de refinera de la composicin que se incluye en la
tabla que sigue y en la que tambien figura la composicin del gas de salida (en base seca).
Componente H2 CH4 C2H6 C3H8 C4H10 N2 CO CO2

Alim. (%v) 9.8 80.54 3.83 1.7 0.44 3.69 0 0
Gas Ref (%V) 76.07 1.88 0 0 0 0.89 8.83 12.31
El vapor de agua introducido con el gas es de 67835 Kg/H. La mezcla de gas de alimentacin y vapor de
agua entra en el horno a una presin de 14,2 Bar y a 364 oC. el gas reformado sale a una presin de
12,8 Bar y a 793 oC. (1 Bar = 100000 Pa)
Flujo de gas = 16000 m3/Hr
Gas de sintesis
Vapor 67835 kg/Hr
Calcular:
a).- El caudal de gas producido y la cantidad de vapor que lo acompaa;
b).- La aproximacin que se consigue con respecto al equilibrio en forma de T para cada una de las reacciones
de
CH4 + H2O ---------------- 3H2 + CO (1)

CO + H2O ---------------- H2 + CO2 (2)
Los valores de las constantes de equilibrio pueden obtenerse en funcin de la temperatura, la T en oK.
ln(_(,1))=30,53(26,938 10 ^3)/(0,747 10 ^6)/^2

+(0,427 10 ^9)/^3
ln(_(,2) )
=2,930632(2,003 10 ^3)/+(1,5563 10 ^6)/^2
(0,31128 10 ^9)/^3
c).- La carga trmica del horno y el flujo medio de calor a travs de la superficie de los tubos.
Comp. H2O H2 CH4 C2H6 C3H8 C4H10 N2 CO CO2

H (Kcal/Kmol) -49380 0 -17890 -20240 -24820 -28500 0 -26420 -94050
Cp (Kcal/KmoloC) 8.3 6.97 10.6 14.2 17.4 20 7.06
(25-364)
Cp (Kcal/KmoloC) 8.96 7.02 13.48 0 0 0 7.37 7.44 11.53
(25-794)
d).- Cual ser la concentracin mxima de hidrgeno que puede alcanzar el gas si se le somete
seguidamente a una conversin y a una descarbonatacin?
d).- Cual ser la concentracin mxima de hidrgeno que puede alcanzar el gas si se le somete
seguidamente a una conversin y a una descarbonatacin?
Solucin
a).-Las entradas al reactor son conocidas y la de salida puede cuantificarse mediante balance de
nitrgeno para los gases y balance de oxgeno de hidrgeno para el agua:
Vol (molar)= 22.4 li/mol _= (1 )/(_

(molar)= 44.6429moles/m3 ) (1000 )/(1 ^3
)
Flujo gas = 16000 m3/Hr
Flujo vapor = 67835 Kg/Hr
Componente Entrada Salida Esto es lo que se quiere

Alim. (%v) Q (m3/Hr) F (kmol/Hr) F (kmol/Hr) Gas Ref (%V)
H2 9.8 1568 70.0 2252.8 76.07 A la entrada se determina el flujo en moles /Hr con la
CH4 80.54 12886.4 575.3 55.7 1.88 composicin y el caudal de flujo en moles.
C2H6 3.83 612.8 27.4 0.0 0 A la salida primeramente se determina el flujo total de
C2H8 1.7 272 12.1 0.0 0 gases tomando en cuenta el el flujo molar del Nitrgeno
que es inerte y el porcentaje de salida, recien con esta
C4H10 0.44 70.4 3.1 0.0 0 base se determina los flujos molares para cada
N2 3.69 590.4 26.4 26.4 0.89 componente
CO 0 0 0 261.5 8.83
CO2 0 0 0 364.6 12.31
Total gas 100.0 16000.0 714.3 2961.5 100.0 =(100 )/(0,89
Vapor kmol/H 3768.6 2774.69 2)26,42/=2961,5Kmol total/Hr
_2=(16000^3 )/ _2=(1568 ^3)/ (44,6 )/ = (100 )/(0,89

(9,8 ^3 2)/(100^3 ) 1 ^3 (1 )/(1000 ) 2) (26,4 2)/
Balance de oxgeno atmico: Balance de hidrgeno atmico:

Gas Entran: Salen Gas Entran: Salen
Como CO 0 261.5 H2 140.0 4505.6
Como CO2 0 729.1 CH4 2301.1 222.7
Como H2O 3768.6 2778.0 = x (por diferencia) C2H6 164.1 0.0
Total 3768.6 3768.6 (debera ser igual) C2H8 97.1 0.0
Flujo de vapor = 2778.0 Kmol/Hr C4H10 31.4 0.0
H2O 7537.2 5542.8 = x (por diferencia)
Total 10271.1 10271.1 (debera ser igual)
Flujo de vapor = 2771.4 kmol/Hr
Flujo de vapor medio = 2774.69 Kmol/Hr
Gas Vapor Reforma

Flujo de reformado (gas y vapor): 2961.5 2774.69 5736.2 Kmol/Hr
Flujo de gas = 16000 m3/Hr

Reator tubular
Gas de sintesis
Gas 2961.5 Kmol/Hr
Reator tubular
Vapor 67835 kg/Hr Vapor 2774.695 Kmol/Hr

Reformado 5736.2 Kmol/Hr
3768.611 Kmol/hr
b).- La aproximacin al equilibrio se expresa, generalmente, como la diferencia entre la temperatura

calculada a partir del valor de la constante de equilibrio con las concentraciones reales de salida y la
temperatura real de salida del reactor (o de cada etapa de reaccin).
Ecuacin Datos Resultados

Tsal = 793 oC ln(Kp,1) = 4.958556
ln(_(,1) )=+/+/^2 Tsal = 1066.15 oK Kp,1 = 142.388
+/^3 A= 30.53
B= -26938
Condiciones de reaccin C= -747000
D= 4.27E+08

_4+ _2 3_2
+
,1=( _2 ^3 nH2 = 2252.8
_)/(_4 nCO = 261.5
_2 )
nCH4 = 55.7
_=_1/_ nH2O = 2774.69
_
Ptotal = 12.8 Bar
,1=( _2 ^3 _)/(_4
ntotal = 5736.2
_2 ) (_/_ )^2 K*p,1 = 96.367031

A= 30.53 ln(Kp,1) = 4.568164
f(T) =+/+/^2 +/^3 B= -26938 T (oK) = 1066.15
ln(_(,1) ) C= -747000 f(T) = 0.390392
D= 4.27E+08 f(T) = 0.023985
f(T) =/^2 2/^3 T (oK) = 1049.873
+3/^4 f(T) = -0.005218
f(T) = 0.024734
+(())/(())
T (oK) = 1050.084 igual
f(T) = -1.31E-05
f(T) = 0.024724
T (oK) = 1050.085 igual
T (oC) = 16.06509 oC
(menor que la salida)

Tsal = 793 oC ln(Kp,1) = 0.060398
ln(_(,1) )=+/+/^2 Tsal = 1066.15 oK Kp,2 = 1.06226
+/^3 A= -2.93063
B= 2003
Condiciones reaccin C= 1556300
D= -3E+08
CO + _2 _2 +
_2
CO + _2 _2 +
_2
nH2 = 2252.8 K*p,2 = 1.131889
,2=(_2 nCO = 261.5
_2)/(_
nCO2 = 364.6 Prcticamente estan en equilibrio
_2 )
nH2O = 2774.7
_=_1/_
_
= / [(/) + _ (/())(25)]
c).- Cual es la carga trmica
364 oC 793 oC
Entrada Salida
H Cp Flujo Calor Cp Flujo Calor
kcal/kmol kcal/KmoloC Kmol/Hr Kcal/Hr kcal/KmoloC Kmol/Hr Kcal/Hr
H2O -49380 8.3 3768.6 -1.75E+08 8.96 2774.69 -1.18E+08
H2 0 6.97 70.0 165398.1 7.02 2252.8 1.21E+07
CH4 -17890 10.6 575.3 -8224630 13.48 55.7 -4.20E+05
C2H6 -20240 14.2 27.4 -422016.76 0 0.0 -0.00E+00
C3H8 -24820 17.4 12.1 -229759.86 0 0.0 -0.00E+00
C4H10 -28500 20 3.1 -68262.857 0 0.0 -0.00E+00
N2 0 7.06 26.4 63081.604 7.37 26.4 1.49E+05
CO -26420 0 0.0 0 7.44 261.5 -5.41E+06
CO2 -94050 0 0.0 0 11.53 364.6 -3.11E+07
-1.84E+08 -1.43E+08
Carga trmica = calor de salida - calor de entrada
Qterm = 4.17E+07 Kcal/Hr
Longitud = 12.3 m
dimetro = 130 mm
No de tubos = 226
Area total = 1135.29 m2 =
Calor superficial:
Q= 36719.745 Kcal/m2 Hr
(El flujo de calor es menor al admitido por lo que se
Q= 153 MJ/m2Hr puede forzar con mayor calor)
Q(admisible) = 170 MJ/m2Hr
d).- Cada mol de CO proporciona un mol de hidrgeno y otro de CO2 por lo que de la composicin de
salida, con una conversin y descarbonatacin completas se pasara a:
Gas reformado Shift Conv. Descarbonatacin

+_2 _2+ _2+_2 + _2 " "
_2 _3 2 _3
Entrada Entrada
Componen (%V) reaccin ResultadoSalida (%v) (%V) reaccin ResultadoSalida (%v)
H2 76.07 8.83 = 84.9 78.0 78.0 0 = 78.0 96.8
CH4 1.88 0 = 1.88 1.7 1.7 0 = 1.7 2.1
C2H6 0 0 = 0 0.0 0.0 0 = 0.0 0.0
C2H8 0 0 = 0 0.0 0.0 0 = 0.0 0.0
C4H10 0 0 = 0 0.0 0.0 0 = 0.0 0.0
N2 0.89 0 = 0.89 0.8 0.8 0 = 0.8 1.0
CO 8.83 -8.83 = 0 0.0 0.0 0 = 0.0 0.0
CO2 12.31 8.83 = 21.14 19.4 19.4 -19.4 = 0.0 0.0
108.81 100 80.6 100
Resumen
Vapor = 67835 kg/Hr
3768.6 kmol/Hr
Comp %V Fi(KmolHr) Steam Comp %V Fi(Kmol/Hr)

H2 9.8% 70.0 reforming H2 76.07% 2252.8
CH4 80.5% 575.3 CH4 1.88% 55.7
C2H6 3.8% 27.4 C2H6 0.00% 0.0
F(m3/Hr)= 16000 C2H8 1.7% 12.1 C2H8 0.00% 0.0
C4H10 0.4% 3.1 C4H10 0.00% 0.0
N2 3.7% 26.4 N2 0.89% 26.4
CO 0.0% 0.0 CO 8.83% 261.5
CO2 0.0% 0.0 CO2 12.31% 364.6
Flujo GN (Kmol/Hr) 714.3 H2O 2774.7
F reformado (Kmol/Hr)
Calor 36719.745 Kcal/m2 Hr

153.48853 MJ/m2Hr
Comp %V (reaccin) Comp Kmol/Hr %V

H2 76.07 8.83 H2 84.9 78.0%
Shift conversion CH4
CH4 1.88 0 1.88 1.7%
C2H6 0 0 C2H6 0 0.0%
C2H8 0 0 +_2 _2+ C2H8 0 0.0%
_2
C4H10 0 0 C4H10 0 0.0%
N2 0.89 0 N2 0.89 0.8%
CO 8.83 -8.83 CO 0 0.0%
CO2 12.31 8.83 CO2 21.14 19.4%
108.81
Comp %V (Reaccion) Comp Flujo %V

H2 78.03 0 H2 78.0 96.840424
CH4 1.73 0 Descarbonatacion CH4 1.7 2.1444052
C2H6 0.00 0 C2H6 0.0 0
C2H8 0.00 0 C2H8 0.0 0
C4H10 0.00 0
_2+_2 + C4H10 0.0 0
_2 " " _3 2 _3
Descarbonatacion

_2+_2 +
_2 " " _3 2 _3
N2 0.82 0 N2 0.8 1.0151705
CO 0.00 0 CO 0.0 0
CO2 19.43 -19.43 CO2 0.0 0
80.6
r
A= B= C= D=
30.53 -26938 -747000 4.3E+08
Condiciones reales P= 12.8 Valores de alfa
ln(_(,1) )=+/+/^2 T (oK) Kp1 0.005 0.003875 0.0031747 0.0028692 0.0028132 0.0028115
+/^3 573 6.9101E-08 0.003875 0.0031747 0.0028692 0.0028132 0.0028115 0.0028115
T(oK) Kp1 0.04 0.0302066 0.0231349 0.0184199 0.0159326 0.0152219

_4+ _2 3_2 673 5.8576E-05 0.0302066 0.0231349 0.0184199 0.0159326 0.0152219 0.015169
+ T(oK) Kp1 0.12 0.0912391 0.0712646 0.0594138 0.054863 0.0542335
1=(
_2 ^3 773 0.009616 0.0912391 0.0712646 0.0594138 0.054863 0.0542335 0.0542223
_)/(_4 T Kp1 0.2 0.169484 0.159301 0.1582581 0.1582479 0.1582479
_2 ) 883 0.7296316 0.169484 0.159301 0.1582581 0.1582479 0.1582479 0.1582479
_=_1/_ T(oK) Kp1 0.8 0.6034227 0.4663374 0.3852174 0.3547927 0.3508398
_
993 21.772113 0.6034227 0.4663374 0.3852174 0.3547927 0.3508398 0.3507783
T(oK) Kp1 0.8 0.6245453 0.5450926 0.5298451 0.5293419 0.5293414
=(^4 ^2)/( (1) ^2
(2+2) ^2 ) 1073 167.58926 0.6245453 0.5450926 0.5298451 0.5293419 0.5293414 0.5293414
T(oK) Kp1 0.8 0.7332019 0.731245 0.7312432 0.7312432 0.7312432
f()=12^2+^4 1173 1460.6153 0.7332019 0.731245 0.7312432 0.7312432 0.7312432 0.7312432
(1(27^2)/4) T(oK) Kp1 0.8 0.8569315 0.8610219 0.8610481 0.8610481 0.8610481
f()=4 + 4^3 1273 9090.5373 0.8569315 0.8610219 0.8610481 0.8610481 0.8610481 0.8610481
(1(27^2)/4) T(oK) Kp1 0.8 0.8989658 0.9253826 0.928594 0.9286465 0.9286465
1373 43429.938 0.8989658 0.9253826 0.928594 0.9286465 0.9286465 0.9286465
=(())/(()) T(oK) Kp1 0.8 0.9088843 0.9483846 0.9602344 0.9617162 0.9617409
1473 167958.72 0.9088843 0.9483846 0.9602344 0.9617162 0.9617409 0.9617409
N= 1 n(1-) n(1-) 3n n n(2-2)

T (oK) CH4 H2O H2 CO nt nt
573 0.003 0.997 0.997 0.008 0.003 2.006 2.006 _4 + _2 3_2
673 0.015 0.985 0.985 0.046 0.015 2.030 2.030 +
n n 0 0
773 0.054 0.946 0.946 0.163 0.054 2.108 2.108 n n 3n n
883 0.158 0.842 0.842 0.475 0.158 2.316 2.316 n(1-) n(1-) 3n n
993 0.351 0.649 0.649 1.052 0.351 2.702 2.702
1073 0.529 0.471 0.471 1.588 0.529 3.059 3.059
nT = 2n(1-)
1173 0.731 0.269 0.269 2.194 0.731 3.462 3.462
1273 0.861 0.139 0.139 2.583 0.861 3.722 3.722
1373 0.92865 0.071 0.071 2.786 0.929 3.857 3.857
1473 0.96174 0.038 0.038 2.885 0.962 3.923 3.923
T (oK) CH4 H2O H2 CO 80%

573 50% 50% 0% 0%
673 49% 49% 2% 1% 70%
773 45% 45% 8% 3% 60%

883 36% 36% 20% 7%
50%
993 24% 24% 39% 13%
Conv %v
1073 15% 15% 52% 17% 40%

1173 8% 8% 63% 21% 30%
1273 4% 4% 69% 23%
1373 2% 2% 72% 24% 20%
1473 1% 1% 74% 25% 10%
0%
500 600 700 800 900 1000 1100 1200 1300 1400 1500
T )oK)
10%
0%
500 600 700 800 900 1000 1100 1200 1300 1400 1500
T )oK)
Ecuacin Datos Resultado

T (oK) Kp1 B
ln(_(,1) )=+/+/^2 A= B= C= D= 573 38.4935 0.86119
+/^3
-2.93063 2003 1556300 -3E+08 673 11.7105 0.77386
CO + _2 _2 + P= 12.8 773 4.90966 0.68903
883 2.41497 0.60846
_2
2=(_2 =^2/ 993 1.41467 0.54325
_2)/(_ (1) ^2 1073 1.03652 0.50448
_2 )
1173 0.75215 0.46446
=(_ )/ 1273 0.57827 0.43196
((1+(_ )) )
1373 0.46465 0.40535
1473 0.38638 0.38332
N= 1 m(1-) m(1-) m m 2m mt
T (oK) m (CO) CO H2O H2 CO2 mt
573 0.861 0.003 0.00039 0.00039 0.002 0.002 0.00562 0.00562
673 0.774 0.015 0.00343 0.00343 0.012 0.012 0.03034 0.03034
773 0.689 0.054 0.01686 0.01686 0.037 0.037 0.10844 0.10844
883 0.608 0.158 0.06196 0.06196 0.096 0.096 0.31650 0.31650
993 0.543 0.351 0.16022 0.16022 0.191 0.191 0.70156 0.70156
1073 0.504 0.529 0.26230 0.26230 0.267 0.267 1.05868 1.05868
1173 0.464 0.731 0.39161 0.39161 0.340 0.340 1.46249 1.46249
1273 0.432 0.861 0.48911 0.48911 0.372 0.372 1.72210 1.72210
1373 0.405 0.929 0.55222 0.55222 0.376 0.376 1.85729 1.85729
1473 0.383 0.962 0.59308 0.59308 0.369 0.369 1.92348 1.92348
0.70000
0.60000
0.50000
0.40000
0.30000
Conv %v
0.20000
0.10000
0.00000
500 600 700 800 900 1000 1100 1200 1300 1400 1500
T )oK)
50%
T (oK) CO H2O H2 CO2 45%
40%
573 7% 7% 43% 43%
35%
673 11% 11% 39% 39% 30%
Conv % v
773 16% 16% 34% 34% 25%

883 20% 20% 30% 30% 20%
993 23% 23% 27% 27% 15%
1073 25% 25% 25% 25% 10%
5%
1173 27% 27% 23% 23%
0%
500 600 700 800 900 1000 1100 1200 1300 1400 1500
T )oK)
25%
Con
20%
15%
10%
5%
0%
1273 28% 28% 22% 22% 500 600 700 800 900 1000 1100 1200 1300 1400 1500
1373 30% 30% 20% 20%
1473 31% 31% 19% 19% T )oK)
Resumen de produccin total
T (oK) CH4 H2 CO CO2 H2O Total CH4 H2 CO CO2 H2O

573 0.997 0.011 0.0004 0.002 0.998 2.008 49.7% 0.5% 0.0% 0.1% 49.7%
673 0.985 0.057 0.0034 0.012 0.988 2.046 48.1% 2.8% 0.2% 0.6% 48.3%
773 0.946 0.200 0.0169 0.037 0.963 2.163 43.7% 9.2% 0.8% 1.7% 44.5%
883 0.842 0.571 0.0620 0.096 0.904 2.475 34.0% 23.1% 2.5% 3.9% 36.5%
993 0.649 1.243 0.1602 0.191 0.809 3.052 21.3% 40.7% 5.2% 6.2% 26.5%
1073 0.471 1.855 0.2623 0.267 0.733 3.588 13.1% 51.7% 7.3% 7.4% 20.4%
1173 0.269 2.533 0.3916 0.340 0.660 4.194 6.4% 60.4% 9.3% 8.1% 15.7%
1273 0.139 2.955 0.4891 0.372 0.628 4.583 3.0% 64.5% 10.7% 8.1% 13.7%
1373 0.071 3.162 0.5522 0.376 0.624 4.786 1.5% 66.1% 11.5% 7.9% 13.0%
1473 0.038 3.254 0.5931 0.369 0.631 4.885 0.8% 66.6% 12.1% 7.5% 12.9%
T (oK) CH4 H2 CO CO2 70%

573 50% 1% 0% 0%
673 48% 3% 0% 1% 60%
773 44% 9% 1% 2% 50%

883 34% 23% 3% 4%
COn %
993 21% 41% 5% 6% 40%
1073 13% 52% 7% 7% 30%

1173 6% 60% 9% 8%
20%
1273 3% 64% 11% 8%
1373 1% 66% 12% 8% 10%
1473 1% 67% 12% 8%
0%
500 600 700 800 900 1000 1100 1200 1300 1400 1500
T
(oK)
3.500
3.000
2.500
Column B
2.000
Column C
Column D
1.500
Column E
Column F
1.000
0.500
0.000
400 600 800 1000 1200 1400 1600
0.500
0.000
400 600 800 1000 1200 1400 1600
3.500
3.000
2.500
Column B
2.000
Column C
Column D
1.500
Column E
Column F
1.000
0.500
0.000
400 600 800 1000 1200 1400 1600
Coeficiente de fugacidad de N2
Temperatura = 673.15 oK
Presion = 2.00E+07 Pa
2

c 3

P RT BoRT Ao
Co 2
bRT a 3 a 6

1 2 e 1

T 2 T 2

()=()+2((_ __)/^2 ) + 3/2 () ^2+6/5 ^5+ /^2 [1/+

(1/+^2/2+^4 ) ^(^2 ) ]
=/
Coeficiente de ecuacion de estado de BWR

Gas Ao Bo Co a b c alfa gama R
Nitrogeno 1.1925 0.0458 5889.1 0.0149 0.0019815 548.064 0.0002915 0.0075 0.082
(mol/li) V(li/mol) 50 100 250 400 673.15

70 0.01 492566.8 505217.6 519622.8 531885.5 553820.0
40 0.03 12148.0 15958.3 19702.8 22747.9 28163.8 500.0
P
20 0.05 -689.1 -22.2 768.6 1449.4 2668.8 400.0
10 0.10 -116.2 -7.6 207.5 412.6 784.1
300.0
5.45 0.18 -43.7 11.9 107.1 195.6 355.7
4.5 0.22 -30.4 13.5 88.4 158.0 283.9 200.0
4 0.25 -23.8 13.9 78.7 139.0 248.1

100.0
3.5 0.29 -17.7 13.9 69.0 120.4 213.5
3 0.33 -12.2 13.5 59.3 102.3 180.1 0.0
0.00 0.10 0.20 0.30 0.40 0.50 0.60 0.70 0.80 0.90 1.00
2.5 0.40 -7.4 12.6 49.6 84.5 147.8 -100.0
2 0.50 -3.5 11.2 39.9 67.1 116.5 V
-200.0
1.5 0.67 -0.7 9.3 30.1 50.0 86.1
1 1.00 1.0 6.9 20.2 33.1 56.6
0.5 2.00 1.2 3.8 10.2 16.5 27.9
0.4 2.50 1.1 3.1 8.1 13.2 22.3
0.3 3.33 0.9 2.3 6.1 9.9 16.7
0.1 10.00 0.4 0.8 2.0 3.3 5.5
0.05 20.00 0.2 0.4 1.0 1.6 2.8
Con la ecuacin de de estado para la presin se Con el valor de densidad molar,, se

T= 673.15 oK determina por NR la densidad molar, que es la determina la fugacidad que es
P= 2.00E+07 Pa
misma que la determinada por la grfica tambin funcion de densidad molar.
P= 197.43337 at
Convergencia de (g) por Newton Rapson Resultados finales

RHO(g) = f(g) f(g) (g) Densidad molar (mol/li)= (g) 3.26
0.05 -194.670 55.331 3.568266 Funcin de fugacidad = F(g) = 296.810
3.57 20.725 68.307 3.264858 fugacidad f = 216.4082
3.26 0.214 66.904 3.261656 Coeficiente de fugacidad= N2 = 1.096
3.26 0.000 66.889 3.261656 Coef. De fugacidad teorico = N2 = 1.189
3.26 0.000 66.889 3.261656
3.26 0.000 66.889 3.261656
Coeficiente de fugacidad de H2
2

3
P RT BoRT Ao Co 2 bRT a 3 a 6 c 1 2 e

1

2
T

T 2

()=()+2((_ __)/^2 ) + 3/2 () ^2+6/5 ^5+ /^2 [1/+

(1/+^2/2+^4 ) ^(^2 ) ]
=/

Hidrogeno 0.097319 0.018041 389.14 -0.009221 0.0001798 -246.13 -3.42E-06 0.00189 0.082
(mol/li) V(li/mol) 50 100 250 400 673.15

70 0.01 6504.4 8003.4 10877.2 13603.3 18540.3
40 0.03 -588.3 852.3 2152.0 3176.7 4991.8
500.0
20 0.05 -557.3 93.9 595.8 965.6 1614.6
10 0.10 -63.8 69.7 240.7 390.8 660.4
400.0
5.872 0.17 0.0 45.7 131.4 212.3 358.8
4.5 0.22 6.8 35.9 98.5 158.8 268.3 300.0
4 0.25 7.9 32.1 86.8 139.9 236.3
3.5 0.29 8.4 28.2 75.4 121.4 205.0 200.0
3 0.33 8.3 24.3 64.1 103.2 174.2
2.5 0.40 7.7 20.4 53.1 85.3 143.9 100.0
2 0.50 6.8 16.3 42.1 67.7 114.1

0.0
1.5 0.67 5.4 12.3 31.4 50.4 84.9
0.00 0.20 0.40 0.60 0.80 1.00
1 1.00 3.8 8.2 20.8 33.3 56.1
-100.0
0.5 2.00 2.0 4.1 10.3 16.5 27.8
0.4 2.50 1.6 3.3 8.2 13.2 22.2
0.3 3.33 1.2 2.5 6.2 9.9 16.6
0.1 10.00 0.4 0.8 2.1 3.3 5.5
0.05 20.00 0.2 0.4 1.0 1.6 2.8
T= 673.15 oK
P= 2.00E+07 Pa
P= 197.4334 at
RHO(g) = f(g) f(g) (g) Resultados finales

0.05 -194.671 55.288 3.571026 Densidad molar (mol/li)= (g) 3.38
3.57 11.970 62.321 3.37896 Funcin de fugacidad = F(g) = 294.977
3.38 0.042 61.902 3.378283 fugacidad (at) = f = 209.3372
3.38 0.000 61.900 3.378283 Coeficiente de fugacidad= H2 = 1.060
3.38 0.000 61.900 3.378283 Coef. De fugacidad teorico = H2 = 1.120
3.38 0.000 61.900 3.378283
Coeficiente de fugacidad de NH3

2

c 3

P RT BoRT Ao
Co 2
bRT a 3 a 6

1 2 e 1

T 2
2
T

()=()+2((_ __)/^2 ) + 3/2 () ^2+6/5 ^5+ /^2 [1/+

(1/+^2/2+^4 ) ^(^2 ) ]
=/

NH3 3.78928 0.051641 178567 0.10354 0.0007196 157.536 4.652E-06 0.0198 0.082
(mol/li) V(li/mol) 50 100 250 400 673.15

70 0.01 -345070.2 -80240.3 267.0 15807.2 32108.5
40 0.03 -124307.8 -37904.1 -11830.0 -6969.6 -2036.3 500.0
20 0.05 -30692.0 -9074.9 -2504.5 -1237.3 91.1

7.935 0.13 -4719.9 -1314.8 -232.6 18.6 322.4 400.0
5.45 0.18 -2212.7 -599.2 -68.2 70.6 251.0

300.0
4.5 0.22 -1504.2 -400.4 -28.8 75.4 215.6
4 0.25 -1186.2 -312.0 -12.9 74.8 195.4
200.0
3.5 0.29 -906.1 -234.8 -0.4 72.1 174.1
3 0.33 -663.8 -168.6 8.9 67.4 151.9
100.0
2.5 0.40 -459.1 -113.4 15.0 60.7 128.7
2 0.50 -292.1 -69.1 18.0 52.1 104.6 0.0
1.5 0.67 -162.7 -35.7 17.9 41.7 79.6 0.00 0.10 0.20 0.30 0.40 0.50 0.60 0.70 0.80 0.90 1.00
1 1.00 -70.9 -13.1 14.8 29.5 53.8 -100.0
0.5 2.00 -16.7 -1.2 8.8 15.6 27.3

0.4 2.50 -10.4 -0.1 7.3 12.6 21.9
0.3 3.33 -5.5 0.5 5.6 9.5 16.4
0.1 10.00 -0.3 0.6 2.0 3.2 5.5
0.05 20.00 0.0 0.4 1.0 1.6 2.8
T= 673.15 oK
P= 2.00E+07 Pa
P= 197.4334 at
RHO(g) = f(g) f(g) (g) Resultados finales

0.05 -194.677 55.065 3.5854295 Densidad molar (mol/li)= (g) 4.05
3.59 -19.583 43.194 4.0388096 Funcin de fugacidad = F(g) = 286.236
4.04 -0.420 41.327 4.0489747 fugacidad (at) = f = 178.6781
4.05 0.000 41.285 4.04898 Coeficiente de fugacidad= NH3 = 0.905
4.05 0.000 41.285 4.04898 Coef. De fugacidad teorico = NH3 = 0.901
4.05 0.000 41.285 4.04898
= /
/^2 [1/+
Calcular el rendimdiento de la produccion de amoniaco:
1/2N2 + 3/2H2 NH 3
Si para la sintesis se suministra la mezcla estequiomtrica a la temperatura de 750 oK y presin de

405,2 105 Pa. Para dicha reaccin la energa libre es:
Go = -37949 + 72,75T log(T) - 16,64x10-3T2 + 1,4x10-6T3 - 102,72xT (J) (esta es la constante real)
Solucin
Energa libre t= 400 oC G = 24289.3 Joule
= ^+ ln()
Log(Ka) = -4.34
T= 673.15 oK Ka = 0.01304 1/at

^= ln(_ ) P= 2.00E+07 Pa Ka = 1.3E-07 1/Pa
R= 8.314 J/(mol-oK)
^=+()+C^2+
A= -37949
^3+ ()
B= 72.75 Otro modelo
Otro modelo C= -0.0166 log(Kp) = -1.8105
log()= 2940/( ) 6,178 D= 1.4E-06 Kp = 0.01547 1/at
E= -102.72 Kp = 1.5E-07 1/Pa
N2 NH3 H2 N2 NH3 H2
_=/ _=/ Tcri(oF) -232.4 270.3 -399.8 red 5.33141 1.65989 20.2383
Pcri (psia) 493 1636.17 188.1 Pred 5.88696 1.77382 15.4294
Tcri(oK) 126.2611 405.5389 33.26111 Con estos datos de anexo Pr vs fug
_=(_^ Pcri(pa) 339734011275103 1296227
_^)/(_^ La constante real se divide por Ka
_^ )
x grafica x fugacidad
_=_ _ _2= 1.189 1.096 K 0.792
_3 0.901 0.9 Ke = 1.2869E-07 1/pa
=_2=
1.12 1.060
Presion = 2.00E+07 Pa
1/2 _2 + 3/2 _2 Ke = 1.3E-07
_3
x = 0.1
Inicio 0.5 1.5 0 x f(x) f(x)
3.00E-07
Transitorio 0,5x 1,5x x 0 -1.29E-07
2.50E-07
Equilibrio 0,5 - 0,5X 1,5-1,5X X 0.1 -1.20E-07
Total 0,5 - 0,5x + 1,5-1,5x + x = 2 -x 0.2 -1.07E-07 2.00E-07
_2=(0,50,5)/ 0.3 -8.86E-08

(2) P
_3=/ 1.50E-07
(2) P 0.4 -6.03E-08
0.5 -1.32E-08 1.00E-07
_2=(1,51,5 0.6 7.34E-08
)/(2) P 5.00E-08
0.7 2.60E-07
0.8 7.95E-07
_=(_3^ ) -3.31E-23
/(_2^(1/2) 0.9 3.68E-06 0 0.1 0.2 0.3 0.4 0.5 0.6 0.7 0.8
_2^(3/2) ) 1 2.03E+24 -5.00E-08
1.1 #VALUE!
f(x) =((2))/((0,50,5)^(1/2)
1.2 #VALUE!
(1,51,5)^(3/2) ) _
1.3 #VALUE!
=/(2)
=/(2) = 35%
0.52
1.20E+01
1.00E+01
8.00E+00
6.00E+00
Column C
4.00E+00
2.00E+00
0.00E+00
0 2 4 6 8 10 12
2431916 becas alemania

Gas de Sintesis-5

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Gas de Sintesis-5

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Constantes para la ecuacin de Benedict - Rubin

Gas Ao Bo Cox10-6 a b cx10-6

Dioxido de carbono 1.34122

Constantes para clculo

T= 200 C <---- Ingrese temperatura

Sustancia = CH4 METHANE

Ref.: - Yaws, Chem.Eng. Abril 1992, p. 130

Comp. H2O H2 CH4 C2H6

178.10 343.15 312.90

90.70 141.62 111.40

89.90 214.63 184.60

85.50 261.14 231.10

189.60 379.84 350.20

134.80 302.98 272.70

133.30 367.91 336.30

C3H8 C4H10 N2 CO CO2

5.5398682 24.07096 7.0240429 7.0344606 9.0140409

C3H8 C4H10 N2 CO CO2

28.441326 56.770293 7.9756421 8.0347688 13.18749

Formula Integral T2 = 637 T2 = 1067

Componente H2 CH4 C2H6 C3H8 C4H10 N2 CO CO2

Flujo de gas = 16000 m3/Hr

CH4 + H2O ---------------- 3H2 + CO (1)

ln(_(,1))=30,53(26,938 10 ^3)/(0,747 10 ^6)/^2

Comp. H2O H2 CH4 C2H6 C3H8 C4H10 N2 CO CO2

Vol (molar)= 22.4 li/mol _= (1 )/(_

Componente Entrada Salida Esto es lo que se quiere

_2=(16000^3 )/ _2=(1568 ^3)/ (44,6 )/ = (100 )/(0,89

Balance de oxgeno atmico: Balance de hidrgeno atmico:

Flujo de vapor medio = 2774.69 Kmol/Hr

Gas Vapor Reforma

Flujo de gas = 16000 m3/Hr

Vapor 67835 kg/Hr Vapor 2774.695 Kmol/Hr

b).- La aproximacin al equilibrio se expresa, generalmente, como la diferencia entre la temperatura

Ecuacin Datos Resultados

Ecuacin Datos Resultados

Ecuacin Datos Resultados

Carga trmica = calor de salida - calor de entrada

Qterm = 4.17E+07 Kcal/Hr

Gas reformado Shift Conv. Descarbonatacin

Comp %V Fi(KmolHr) Steam Comp %V Fi(Kmol/Hr)

Calor 36719.745 Kcal/m2 Hr

Comp %V (reaccin) Comp Kmol/Hr %V

Comp %V (Reaccion) Comp Flujo %V

N= 1 n(1-) n(1-) 3n n n(2-2)

T (oK) CH4 H2O H2 CO 80%

773 45% 45% 8% 3% 60%

1073 15% 15% 52% 17% 40%

Ecuacin Datos Resultado

773 16% 16% 34% 34% 25%

Resumen de produccin total

T (oK) CH4 H2 CO CO2 H2O Total CH4 H2 CO CO2 H2O

T (oK) CH4 H2 CO CO2 70%

773 44% 9% 1% 2% 50%

993 21% 41% 5% 6% 40%

1073 13% 52% 7% 7% 30%

()=()+2((_ __)/^2 ) + 3/2 () ^2+6/5 ^5+ /^2 [1/+

Coeficiente de ecuacion de estado de BWR

(mol/li) V(li/mol) 50 100 250 400 673.15

4 0.25 -23.8 13.9 78.7 139.0 248.1

Con la ecuacin de de estado para la presin se Con el valor de densidad molar,, se

Convergencia de (g) por Newton Rapson Resultados finales

()=()+2((_ __)/^2 ) + 3/2 () ^2+6/5 ^5+ /^2 [1/+

Gas Ao Bo Co a b c alfa gama R