methanol oxidane
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 | 206.46 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 216.37 | 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 | 61.31 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 94.57 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 157.54 | J mol-1 K-1 |
| Rotational | 102.82 | J mol-1 K-1 |
| Vibrational | 99.36 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 359.72 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -446.55 | kJ mol-1 |
Molecular Orbitals
- 1 -551.01 eV View
- 2 -550.66 eV View
- 3 -301.43 eV View
- 4 -34.92 eV View
- 5 -34.84 eV View
- 6 -23.55 eV View
- 7 -17.42 eV View
- 8 -16.67 eV View
- 9 -15.40 eV View
- 10 -13.97 eV View
- 11 -12.57 eV View
- 12 -11.14 eV View
- 13 -10.73 eV View
- 14 -9.27 eV View
- 15 15.92 eV View
- 16 17.09 eV View
- 17 18.49 eV View
- 18 19.36 eV View
- 19 20.05 eV View
- 20 20.31 eV View
- 21 21.57 eV View