Methoxycyclohexane
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 | 534.58 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 544.50 | 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 | 109.37 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 142.62 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 167.83 | J mol-1 K-1 |
| Rotational | 118.75 | J mol-1 K-1 |
| Vibrational | 84.43 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 371.01 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -275.89 | kJ mol-1 |
Molecular Orbitals
- 1 -550.95 eV View
- 2 -301.70 eV View
- 3 -301.61 eV View
- 4 -300.46 eV View
- 5 -300.41 eV View
- 6 -300.40 eV View
- 7 -300.36 eV View
- 8 -300.34 eV View
- 9 -35.27 eV View
- 10 -29.23 eV View
- 11 -26.31 eV View
- 12 -26.03 eV View
- 13 -23.56 eV View
- 14 -21.58 eV View
- 15 -20.96 eV View
- 16 -19.66 eV View
- 17 -16.95 eV View
- 18 -16.21 eV View
- 19 -15.81 eV View
- 20 -15.72 eV View
- 21 -15.20 eV View
- 22 -14.92 eV View
- 23 -13.80 eV View
- 24 -13.40 eV View
- 25 -12.88 eV View
- 26 -12.52 eV View
- 27 -12.23 eV View
- 28 -11.51 eV View
- 29 -11.07 eV View
- 30 -10.61 eV View
- 31 -10.02 eV View
- 32 -8.57 eV View
- 33 14.37 eV View
- 34 15.46 eV View
- 35 16.18 eV View
- 36 16.60 eV View
- 37 17.06 eV View
- 38 17.70 eV View
- 39 18.09 eV View
- 40 18.57 eV View
- 41 18.79 eV View
- 42 18.95 eV View
- 43 19.38 eV View
- 44 19.59 eV View
- 45 19.91 eV View
- 46 20.23 eV View
- 47 20.40 eV View
- 48 20.94 eV View
- 49 21.31 eV View
- 50 21.54 eV View
- 51 21.84 eV View
- 52 22.07 eV View
- 53 22.57 eV View
- 54 23.21 eV View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | 11.37 | kJ mol-1 |
| Polar Solvation Energy | -7.49 | kJ mol-1 |
| Nonpolar Solvation Energy | 18.85 | kJ mol-1 |
| Surface Area | 116.54 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 1.53 | Debye |