--- thermo.dat 2015/01/25 23:23:47 2.2 +++ thermo.dat 2015/03/25 00:36:21 2.3 @@ -311,7 +311,7 @@ 2.88377470E+04 1.33587759E+01 2.47223165E+00 1.75096865E-02 1.54166152E-06 3 -1.03357169E-08 4.31484742E-12 2.89681156E+04 1.36627279E+01 4 ! CAS# : 6067-68-1 -! DfH = 268.30 kJ/mol, Cp = 63.68 J/mol/K, S = 271.77 J/mol/K +! DfH = 268.30 kJ/mol, Cp = 63.68 J/mol/K, S = 277.54 J/mol/K ! Entropy changed for cis/trans isomer (deg=2) S-C3H5 H 5 C 3 O 0 G 298.0 3000.0 1000.0 1 2.88965689E+00 2.06484496E-02-1.02005529E-05 2.45220758E-09-2.32477736E-13 2