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 | 206.58 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 216.50 | 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 | 60.76 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 94.02 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 157.54 | J mol-1 K-1 |
| Rotational | 101.75 | J mol-1 K-1 |
| Vibrational | 86.84 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 346.13 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -447.98 | kJ mol-1 |
Molecular Orbitals
- 1 -551.49 eV View
- 2 -550.11 eV View
- 3 -302.03 eV View
- 4 -35.66 eV View
- 5 -34.00 eV View
- 6 -24.18 eV View
- 7 -17.40 eV View
- 8 -16.55 eV View
- 9 -16.02 eV View
- 10 -14.62 eV View
- 11 -11.82 eV View
- 12 -11.55 eV View
- 13 -10.14 eV View
- 14 -10.04 eV View
- 15 15.78 eV View
- 16 17.07 eV View
- 17 17.99 eV View
- 18 18.80 eV View
- 19 19.42 eV View
- 20 20.77 eV View
- 21 21.26 eV View
Vibrational Frequencies
| Vibration |
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| Vectors |
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| Balls |
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- 1 53.16 cm-1 View
- 2 84.63 cm-1 View
- 3 94.90 cm-1 View
- 4 119.83 cm-1 View
- 5 167.96 cm-1 View
- 6 293.44 cm-1 View
- 7 304.71 cm-1 View
- 8 993.09 cm-1 View
- 9 1020.13 cm-1 View
- 10 1162.22 cm-1 View
- 11 1356.11 cm-1 View
- 12 1361.13 cm-1 View
- 13 1363.99 cm-1 View
- 14 1405.78 cm-1 View
- 15 1753.95 cm-1 View
- 16 3040.98 cm-1 View
- 17 3069.80 cm-1 View
- 18 3131.42 cm-1 View
- 19 3856.49 cm-1 View
- 20 3896.92 cm-1 View
- 21 3980.39 cm-1 View