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 | 206.82 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 216.73 | 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 | 59.37 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 92.62 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 157.54 | J mol-1 K-1 |
| Rotational | 102.02 | J mol-1 K-1 |
| Vibrational | 75.14 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 334.71 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -446.43 | kJ mol-1 |
Molecular Orbitals
- 1 -550.90 eV View
- 2 -550.82 eV View
- 3 -301.59 eV View
- 4 -35.09 eV View
- 5 -34.69 eV View
- 6 -23.70 eV View
- 7 -17.36 eV View
- 8 -16.75 eV View
- 9 -15.54 eV View
- 10 -14.13 eV View
- 11 -12.40 eV View
- 12 -11.09 eV View
- 13 -10.81 eV View
- 14 -9.48 eV View
- 15 15.68 eV View
- 16 17.11 eV View
- 17 18.32 eV View
- 18 19.19 eV View
- 19 19.76 eV View
- 20 20.59 eV View
- 21 21.35 eV View