Cyclohexane
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 | 444.64 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 454.56 | 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 | 72.47 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 105.73 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 164.02 | J mol-1 K-1 |
| Rotational | 110.07 | J mol-1 K-1 |
| Vibrational | 47.76 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 321.85 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -112.59 | kJ mol-1 |
Molecular Orbitals
- 1 -300.28 eV View
- 2 -300.27 eV View
- 3 -300.27 eV View
- 4 -300.27 eV View
- 5 -300.26 eV View
- 6 -300.25 eV View
- 7 -29.26 eV View
- 8 -26.10 eV View
- 9 -26.08 eV View
- 10 -21.76 eV View
- 11 -21.48 eV View
- 12 -18.52 eV View
- 13 -16.94 eV View
- 14 -16.77 eV View
- 15 -15.31 eV View
- 16 -14.19 eV View
- 17 -13.20 eV View
- 18 -13.04 eV View
- 19 -12.88 eV View
- 20 -12.59 eV View
- 21 -12.33 eV View
- 22 -10.56 eV View
- 23 -10.52 eV View
- 24 -10.48 eV View
- 25 15.10 eV View
- 26 16.32 eV View
- 27 16.35 eV View
- 28 16.80 eV View
- 29 17.80 eV View
- 30 17.90 eV View
- 31 18.14 eV View
- 32 18.49 eV View
- 33 19.94 eV View
- 34 20.38 eV View
- 35 20.70 eV View
- 36 21.30 eV View
- 37 21.35 eV View
- 38 21.51 eV View
- 39 21.55 eV View
- 40 23.09 eV View
- 41 23.31 eV View
- 42 23.67 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 83.11 cm-1 View
- 2 212.34 cm-1 View
- 3 260.63 cm-1 View
- 4 456.70 cm-1 View
- 5 483.21 cm-1 View
- 6 603.65 cm-1 View
- 7 772.42 cm-1 View
- 8 778.92 cm-1 View
- 9 890.71 cm-1 View
- 10 929.33 cm-1 View
- 11 948.11 cm-1 View
- 12 953.96 cm-1 View
- 13 955.36 cm-1 View
- 14 980.33 cm-1 View
- 15 1064.24 cm-1 View
- 16 1096.76 cm-1 View
- 17 1098.28 cm-1 View
- 18 1102.43 cm-1 View
- 19 1105.45 cm-1 View
- 20 1115.81 cm-1 View
- 21 1123.45 cm-1 View
- 22 1147.58 cm-1 View
- 23 1163.90 cm-1 View
- 24 1175.79 cm-1 View
- 25 1262.31 cm-1 View
- 26 1309.04 cm-1 View
- 27 1319.55 cm-1 View
- 28 1347.87 cm-1 View
- 29 1348.66 cm-1 View
- 30 1360.06 cm-1 View
- 31 1392.90 cm-1 View
- 32 1415.05 cm-1 View
- 33 1416.90 cm-1 View
- 34 1417.36 cm-1 View
- 35 1417.91 cm-1 View
- 36 1419.57 cm-1 View
- 37 2947.54 cm-1 View
- 38 2950.47 cm-1 View
- 39 2953.91 cm-1 View
- 40 2961.45 cm-1 View
- 41 2964.97 cm-1 View
- 42 2969.51 cm-1 View
- 43 3035.97 cm-1 View
- 44 3037.16 cm-1 View
- 45 3038.82 cm-1 View
- 46 3043.56 cm-1 View
- 47 3044.69 cm-1 View
- 48 3047.50 cm-1 View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | 17.94 | kJ mol-1 |
| Polar Solvation Energy | -0.74 | kJ mol-1 |
| Nonpolar Solvation Energy | 18.68 | kJ mol-1 |
| Surface Area | 94.51 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 0.01 | Debye |