3,3-dimethylcyclohexene
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 | 539.14 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 549.06 | 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 | 112.96 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 146.22 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 167.38 | J mol-1 K-1 |
| Rotational | 117.28 | J mol-1 K-1 |
| Vibrational | 81.02 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 365.68 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -64.69 | kJ mol-1 |
Molecular Orbitals
- 1 -300.79 eV View
- 2 -300.46 eV View
- 3 -300.36 eV View
- 4 -300.27 eV View
- 5 -300.12 eV View
- 6 -300.11 eV View
- 7 -299.55 eV View
- 8 -299.46 eV View
- 9 -29.72 eV View
- 10 -27.41 eV View
- 11 -26.05 eV View
- 12 -24.21 eV View
- 13 -23.78 eV View
- 14 -21.21 eV View
- 15 -20.26 eV View
- 16 -17.64 eV View
- 17 -16.84 eV View
- 18 -15.64 eV View
- 19 -15.36 eV View
- 20 -15.01 eV View
- 21 -14.58 eV View
- 22 -13.90 eV View
- 23 -13.69 eV View
- 24 -13.28 eV View
- 25 -12.56 eV View
- 26 -12.46 eV View
- 27 -12.25 eV View
- 28 -11.21 eV View
- 29 -10.65 eV View
- 30 -10.30 eV View
- 31 -7.74 eV View
- 32 8.85 eV View
- 33 15.51 eV View
- 34 15.95 eV View
- 35 16.30 eV View
- 36 16.66 eV View
- 37 17.59 eV View
- 38 18.14 eV View
- 39 18.47 eV View
- 40 19.10 eV View
- 41 19.37 eV View
- 42 19.67 eV View
- 43 20.10 eV View
- 44 20.23 eV View
- 45 20.39 eV View
- 46 20.60 eV View
- 47 20.96 eV View
- 48 21.42 eV View
- 49 21.57 eV View
- 50 21.74 eV View
- 51 22.37 eV View
- 52 22.91 eV View
- 53 26.30 eV View
- 54 28.94 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 86.48 cm-1 View
- 2 176.59 cm-1 View
- 3 205.49 cm-1 View
- 4 216.74 cm-1 View
- 5 261.60 cm-1 View
- 6 330.12 cm-1 View
- 7 369.60 cm-1 View
- 8 433.09 cm-1 View
- 9 482.89 cm-1 View
- 10 509.82 cm-1 View
- 11 527.26 cm-1 View
- 12 700.79 cm-1 View
- 13 767.67 cm-1 View
- 14 827.83 cm-1 View
- 15 877.90 cm-1 View
- 16 931.87 cm-1 View
- 17 952.48 cm-1 View
- 18 958.64 cm-1 View
- 19 964.00 cm-1 View
- 20 972.53 cm-1 View
- 21 978.67 cm-1 View
- 22 1003.31 cm-1 View
- 23 1026.66 cm-1 View
- 24 1044.43 cm-1 View
- 25 1067.98 cm-1 View
- 26 1110.90 cm-1 View
- 27 1130.15 cm-1 View
- 28 1151.72 cm-1 View
- 29 1163.91 cm-1 View
- 30 1222.88 cm-1 View
- 31 1246.52 cm-1 View
- 32 1286.00 cm-1 View
- 33 1326.70 cm-1 View
- 34 1353.50 cm-1 View
- 35 1366.31 cm-1 View
- 36 1389.11 cm-1 View
- 37 1393.68 cm-1 View
- 38 1399.74 cm-1 View
- 39 1402.96 cm-1 View
- 40 1405.18 cm-1 View
- 41 1408.99 cm-1 View
- 42 1412.08 cm-1 View
- 43 1412.58 cm-1 View
- 44 1415.29 cm-1 View
- 45 1431.57 cm-1 View
- 46 1885.68 cm-1 View
- 47 2943.43 cm-1 View
- 48 2951.61 cm-1 View
- 49 2960.02 cm-1 View
- 50 3025.26 cm-1 View
- 51 3030.41 cm-1 View
- 52 3038.24 cm-1 View
- 53 3039.07 cm-1 View
- 54 3060.19 cm-1 View
- 55 3078.17 cm-1 View
- 56 3079.96 cm-1 View
- 57 3081.04 cm-1 View
- 58 3083.89 cm-1 View
- 59 3174.44 cm-1 View
- 60 3177.74 cm-1 View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | 16.84 | kJ mol-1 |
| Polar Solvation Energy | -2.19 | kJ mol-1 |
| Nonpolar Solvation Energy | 19.02 | kJ mol-1 |
| Surface Area | 112.61 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 0.19 | Debye |