Cyclohexene
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 | 383.74 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 393.66 | 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 | 65.82 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 99.08 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 163.72 | J mol-1 K-1 |
| Rotational | 109.36 | J mol-1 K-1 |
| Vibrational | 37.87 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 310.94 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -20.38 | kJ mol-1 |
Molecular Orbitals
- 1 -300.47 eV View
- 2 -300.47 eV View
- 3 -300.39 eV View
- 4 -300.38 eV View
- 5 -299.57 eV View
- 6 -299.55 eV View
- 7 -29.29 eV View
- 8 -26.12 eV View
- 9 -26.04 eV View
- 10 -21.74 eV View
- 11 -21.08 eV View
- 12 -17.85 eV View
- 13 -17.12 eV View
- 14 -15.63 eV View
- 15 -14.97 eV View
- 16 -14.09 eV View
- 17 -13.51 eV View
- 18 -13.44 eV View
- 19 -13.19 eV View
- 20 -11.58 eV View
- 21 -10.98 eV View
- 22 -10.58 eV View
- 23 -7.73 eV View
- 24 8.82 eV View
- 25 16.09 eV View
- 26 16.25 eV View
- 27 16.71 eV View
- 28 16.85 eV View
- 29 18.62 eV View
- 30 18.91 eV View
- 31 19.17 eV View
- 32 19.88 eV View
- 33 20.46 eV View
- 34 20.86 eV View
- 35 21.23 eV View
- 36 21.27 eV View
- 37 21.86 eV View
- 38 22.56 eV View
- 39 26.21 eV View
- 40 28.86 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 137.29 cm-1 View
- 2 256.14 cm-1 View
- 3 367.33 cm-1 View
- 4 487.42 cm-1 View
- 5 505.13 cm-1 View
- 6 682.45 cm-1 View
- 7 759.04 cm-1 View
- 8 819.02 cm-1 View
- 9 934.09 cm-1 View
- 10 936.69 cm-1 View
- 11 947.23 cm-1 View
- 12 967.03 cm-1 View
- 13 971.52 cm-1 View
- 14 1008.96 cm-1 View
- 15 1055.68 cm-1 View
- 16 1056.14 cm-1 View
- 17 1100.87 cm-1 View
- 18 1104.25 cm-1 View
- 19 1122.99 cm-1 View
- 20 1139.90 cm-1 View
- 21 1148.84 cm-1 View
- 22 1177.29 cm-1 View
- 23 1241.51 cm-1 View
- 24 1312.54 cm-1 View
- 25 1343.13 cm-1 View
- 26 1368.60 cm-1 View
- 27 1383.65 cm-1 View
- 28 1395.40 cm-1 View
- 29 1410.14 cm-1 View
- 30 1417.70 cm-1 View
- 31 1437.90 cm-1 View
- 32 1879.38 cm-1 View
- 33 2944.81 cm-1 View
- 34 2945.20 cm-1 View
- 35 2961.28 cm-1 View
- 36 2968.70 cm-1 View
- 37 3026.07 cm-1 View
- 38 3026.13 cm-1 View
- 39 3040.60 cm-1 View
- 40 3046.17 cm-1 View
- 41 3046.63 cm-1 View
- 42 3066.71 cm-1 View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | 15.52 | kJ mol-1 |
| Polar Solvation Energy | -2.68 | kJ mol-1 |
| Nonpolar Solvation Energy | 18.18 | kJ mol-1 |
| Surface Area | 92.78 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 0.22 | Debye |