Cyclohexanol
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 | 460.79 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 470.71 | 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 | 89.38 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 122.64 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 166.19 | J mol-1 K-1 |
| Rotational | 114.70 | J mol-1 K-1 |
| Vibrational | 55.91 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 336.80 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -297.55 | kJ mol-1 |
Molecular Orbitals
- 1 -550.75 eV View
- 2 -301.72 eV View
- 3 -300.50 eV View
- 4 -300.46 eV View
- 5 -300.42 eV View
- 6 -300.41 eV View
- 7 -300.34 eV View
- 8 -35.05 eV View
- 9 -29.19 eV View
- 10 -26.35 eV View
- 11 -25.70 eV View
- 12 -21.69 eV View
- 13 -21.18 eV View
- 14 -19.64 eV View
- 15 -16.85 eV View
- 16 -16.55 eV View
- 17 -15.68 eV View
- 18 -15.48 eV View
- 19 -14.49 eV View
- 20 -13.45 eV View
- 21 -13.25 eV View
- 22 -13.03 eV View
- 23 -12.29 eV View
- 24 -11.68 eV View
- 25 -11.40 eV View
- 26 -10.84 eV View
- 27 -10.21 eV View
- 28 -9.18 eV View
- 29 14.79 eV View
- 30 15.58 eV View
- 31 16.05 eV View
- 32 16.66 eV View
- 33 17.51 eV View
- 34 17.73 eV View
- 35 18.52 eV View
- 36 18.79 eV View
- 37 19.28 eV View
- 38 19.76 eV View
- 39 19.89 eV View
- 40 20.23 eV View
- 41 20.83 eV View
- 42 21.29 eV View
- 43 21.37 eV View
- 44 21.70 eV View
- 45 21.96 eV View
- 46 22.52 eV View
- 47 22.74 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 145.37 cm-1 View
- 2 216.20 cm-1 View
- 3 258.13 cm-1 View
- 4 311.68 cm-1 View
- 5 381.43 cm-1 View
- 6 420.97 cm-1 View
- 7 471.04 cm-1 View
- 8 494.21 cm-1 View
- 9 591.01 cm-1 View
- 10 817.67 cm-1 View
- 11 852.80 cm-1 View
- 12 912.80 cm-1 View
- 13 927.50 cm-1 View
- 14 945.01 cm-1 View
- 15 956.51 cm-1 View
- 16 989.77 cm-1 View
- 17 1053.06 cm-1 View
- 18 1071.28 cm-1 View
- 19 1084.39 cm-1 View
- 20 1111.59 cm-1 View
- 21 1124.51 cm-1 View
- 22 1135.26 cm-1 View
- 23 1150.22 cm-1 View
- 24 1152.54 cm-1 View
- 25 1159.58 cm-1 View
- 26 1164.09 cm-1 View
- 27 1209.34 cm-1 View
- 28 1253.43 cm-1 View
- 29 1274.85 cm-1 View
- 30 1332.33 cm-1 View
- 31 1334.94 cm-1 View
- 32 1362.61 cm-1 View
- 33 1382.02 cm-1 View
- 34 1398.17 cm-1 View
- 35 1404.05 cm-1 View
- 36 1415.57 cm-1 View
- 37 1415.71 cm-1 View
- 38 1419.94 cm-1 View
- 39 1425.21 cm-1 View
- 40 2827.80 cm-1 View
- 41 2953.47 cm-1 View
- 42 2956.48 cm-1 View
- 43 2962.24 cm-1 View
- 44 2965.91 cm-1 View
- 45 2969.28 cm-1 View
- 46 3033.76 cm-1 View
- 47 3036.52 cm-1 View
- 48 3039.74 cm-1 View
- 49 3043.41 cm-1 View
- 50 3045.90 cm-1 View
- 51 3901.78 cm-1 View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | 11.81 | kJ mol-1 |
| Polar Solvation Energy | -10.23 | kJ mol-1 |
| Nonpolar Solvation Energy | 22.03 | kJ mol-1 |
| Surface Area | 98.24 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 1.78 | Debye |