Propane-1,2,3-triol
Molecule Viewer
Thermodynamics at 298.15 K and standard pressure
| Enthalpy | ||
| Property | Value | Unit |
| Translational | 6.20 | kJ mol-1 |
| Rotational | 3.72 | kJ mol-1 |
| Vibrational | 318.81 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 328.73 | kJ mol-1 |
| Heat Capacity at Constant Pressure | ||
| Property | Value | Unit |
| Translational | 20.79 | J mol-1 K-1 |
| Rotational | 12.47 | J mol-1 K-1 |
| Vibrational | 82.33 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 115.59 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 165.15 | J mol-1 K-1 |
| Rotational | 111.96 | J mol-1 K-1 |
| Vibrational | 67.44 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 344.54 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -608.81 | kJ mol-1 |
Molecular Orbitals
- 1 -551.47 eV View
- 2 -551.28 eV View
- 3 -551.27 eV View
- 4 -302.16 eV View
- 5 -302.07 eV View
- 6 -302.05 eV View
- 7 -36.19 eV View
- 8 -35.50 eV View
- 9 -35.14 eV View
- 10 -26.62 eV View
- 11 -23.80 eV View
- 12 -20.89 eV View
- 13 -17.99 eV View
- 14 -17.12 eV View
- 15 -16.95 eV View
- 16 -15.95 eV View
- 17 -14.99 eV View
- 18 -14.32 eV View
- 19 -13.39 eV View
- 20 -12.09 eV View
- 21 -11.83 eV View
- 22 -11.29 eV View
- 23 -10.63 eV View
- 24 -9.76 eV View
- 25 -8.85 eV View
- 26 13.80 eV View
- 27 15.27 eV View
- 28 16.37 eV View
- 29 16.89 eV View
- 30 17.18 eV View
- 31 18.31 eV View
- 32 18.51 eV View
- 33 19.36 eV View
- 34 19.47 eV View
- 35 20.02 eV View
- 36 20.73 eV View
- 37 21.57 eV View
- 38 22.07 eV View
Vibrational Frequencies
| Vibration |
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| Vectors |
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| Balls |
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- 1 78.23 cm-1 View
- 2 120.33 cm-1 View
- 3 254.50 cm-1 View
- 4 300.49 cm-1 View
- 5 318.47 cm-1 View
- 6 363.24 cm-1 View
- 7 430.80 cm-1 View
- 8 461.54 cm-1 View
- 9 510.98 cm-1 View
- 10 748.92 cm-1 View
- 11 856.58 cm-1 View
- 12 889.36 cm-1 View
- 13 942.18 cm-1 View
- 14 1004.64 cm-1 View
- 15 1051.33 cm-1 View
- 16 1065.34 cm-1 View
- 17 1081.97 cm-1 View
- 18 1136.43 cm-1 View
- 19 1144.10 cm-1 View
- 20 1235.99 cm-1 View
- 21 1318.75 cm-1 View
- 22 1324.94 cm-1 View
- 23 1350.86 cm-1 View
- 24 1366.90 cm-1 View
- 25 1371.54 cm-1 View
- 26 1376.34 cm-1 View
- 27 1384.71 cm-1 View
- 28 1415.93 cm-1 View
- 29 2906.44 cm-1 View
- 30 2944.64 cm-1 View
- 31 2949.27 cm-1 View
- 32 3024.00 cm-1 View
- 33 3026.79 cm-1 View
- 34 3868.04 cm-1 View
- 35 3872.05 cm-1 View
- 36 3882.94 cm-1 View