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 | 206.75 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 216.67 | 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 | 60.33 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 93.58 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 157.54 | J mol-1 K-1 |
| Rotational | 100.75 | J mol-1 K-1 |
| Vibrational | 88.95 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 347.25 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -447.09 | kJ mol-1 |
Molecular Orbitals
- 1 -551.01 eV View
- 2 -550.72 eV View
- 3 -301.70 eV View
- 4 -35.22 eV View
- 5 -34.59 eV View
- 6 -23.83 eV View
- 7 -17.13 eV View
- 8 -16.97 eV View
- 9 -15.68 eV View
- 10 -14.26 eV View
- 11 -12.27 eV View
- 12 -11.27 eV View
- 13 -10.64 eV View
- 14 -9.60 eV View
- 15 15.98 eV View
- 16 16.96 eV View
- 17 18.18 eV View
- 18 19.10 eV View
- 19 19.77 eV View
- 20 20.57 eV View
- 21 21.23 eV View