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 | 206.56 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 216.48 | 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 | 60.79 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 94.05 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 157.54 | J mol-1 K-1 |
| Rotational | 101.72 | J mol-1 K-1 |
| Vibrational | 84.03 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 343.30 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -448.05 | kJ mol-1 |
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 77.07 cm-1 View
- 2 87.38 cm-1 View
- 3 101.79 cm-1 View
- 4 105.35 cm-1 View
- 5 172.62 cm-1 View
- 6 284.76 cm-1 View
- 7 302.64 cm-1 View
- 8 994.55 cm-1 View
- 9 1020.04 cm-1 View
- 10 1162.33 cm-1 View
- 11 1356.33 cm-1 View
- 12 1361.04 cm-1 View
- 13 1363.48 cm-1 View
- 14 1405.82 cm-1 View
- 15 1753.67 cm-1 View
- 16 3040.44 cm-1 View
- 17 3069.21 cm-1 View
- 18 3130.04 cm-1 View
- 19 3856.74 cm-1 View
- 20 3897.20 cm-1 View
- 21 3980.68 cm-1 View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | 34.45 | kJ mol-1 |
| Polar Solvation Energy | -17.49 | kJ mol-1 |
| Nonpolar Solvation Energy | 51.96 | kJ mol-1 |
| Surface Area | 73.95 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 3.38 | Debye |