oxidane methanol
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 | 204.11 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 214.03 | 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 | 52.57 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 85.83 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 157.54 | J mol-1 K-1 |
| Rotational | 101.37 | J mol-1 K-1 |
| Vibrational | 69.96 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 328.87 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -447.00 | kJ mol-1 |
Molecular Orbitals
- 1 -551.53 eV View
- 2 -550.06 eV View
- 3 -302.07 eV View
- 4 -35.69 eV View
- 5 -33.96 eV View
- 6 -24.21 eV View
- 7 -17.40 eV View
- 8 -16.52 eV View
- 9 -16.05 eV View
- 10 -14.66 eV View
- 11 -11.90 eV View
- 12 -11.47 eV View
- 13 -10.11 eV View
- 14 -10.05 eV View
- 15 15.83 eV View
- 16 17.32 eV View
- 17 17.76 eV View
- 18 18.77 eV View
- 19 19.37 eV View
- 20 20.74 eV View
- 21 21.16 eV View
Vibrational Frequencies
| Vibration |
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| Vectors |
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| Balls |
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- 1 19.10 cm-1 View
- 2 77.51 cm-1 View
- 3 89.17 cm-1 View
- 4 93.66 cm-1 View
- 5 179.83 cm-1 View
- 6 272.59 cm-1 View
- 7 326.33 cm-1 View
- 8 986.64 cm-1 View
- 9 1020.37 cm-1 View
- 10 1161.60 cm-1 View
- 11 1355.04 cm-1 View
- 12 1363.00 cm-1 View
- 13 1363.76 cm-1 View
- 14 1405.35 cm-1 View
- 15 1755.72 cm-1 View
- 16 3039.88 cm-1 View
- 17 3070.70 cm-1 View
- 18 3139.80 cm-1 View
- 19 3858.57 cm-1 View
- 20 3895.08 cm-1 View
- 21 3982.30 cm-1 View