(4r)-1-methyl-4-prop-1-en-2-ylcyclohexene
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 | 631.48 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 641.39 | 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 | 146.72 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 179.98 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 170.03 | J mol-1 K-1 |
| Rotational | 123.53 | J mol-1 K-1 |
| Vibrational | 125.67 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 419.23 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -6.31 | kJ mol-1 |
Molecular Orbitals
- 1 -300.62 eV View
- 2 -300.44 eV View
- 3 -300.43 eV View
- 4 -300.40 eV View
- 5 -300.32 eV View
- 6 -300.30 eV View
- 7 -299.98 eV View
- 8 -299.79 eV View
- 9 -299.40 eV View
- 10 -299.12 eV View
- 11 -29.77 eV View
- 12 -28.11 eV View
- 13 -26.41 eV View
- 14 -26.17 eV View
- 15 -24.31 eV View
- 16 -23.65 eV View
- 17 -21.79 eV View
- 18 -20.93 eV View
- 19 -18.57 eV View
- 20 -17.25 eV View
- 21 -16.73 eV View
- 22 -15.87 eV View
- 23 -15.58 eV View
- 24 -15.14 eV View
- 25 -14.78 eV View
- 26 -14.68 eV View
- 27 -14.13 eV View
- 28 -13.74 eV View
- 29 -13.49 eV View
- 30 -13.30 eV View
- 31 -12.82 eV View
- 32 -12.50 eV View
- 33 -12.21 eV View
- 34 -11.15 eV View
- 35 -10.79 eV View
- 36 -10.40 eV View
- 37 -7.89 eV View
- 38 -7.33 eV View
- 39 8.65 eV View
- 40 8.82 eV View
- 41 15.38 eV View
- 42 16.02 eV View
- 43 16.44 eV View
- 44 16.60 eV View
- 45 16.73 eV View
- 46 17.75 eV View
- 47 18.12 eV View
- 48 18.45 eV View
- 49 18.91 eV View
- 50 19.09 eV View
- 51 19.51 eV View
- 52 19.67 eV View
- 53 19.87 eV View
- 54 20.02 eV View
- 55 20.25 eV View
- 56 20.57 eV View
- 57 20.88 eV View
- 58 21.40 eV View
- 59 21.64 eV View
- 60 22.22 eV View
- 61 22.51 eV View
- 62 23.48 eV View
- 63 26.07 eV View
- 64 26.54 eV View
- 65 28.73 eV View
- 66 29.48 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 51.74 cm-1 View
- 2 55.24 cm-1 View
- 3 116.04 cm-1 View
- 4 145.99 cm-1 View
- 5 197.94 cm-1 View
- 6 262.26 cm-1 View
- 7 282.34 cm-1 View
- 8 327.55 cm-1 View
- 9 354.55 cm-1 View
- 10 363.11 cm-1 View
- 11 456.38 cm-1 View
- 12 506.39 cm-1 View
- 13 520.91 cm-1 View
- 14 562.86 cm-1 View
- 15 603.67 cm-1 View
- 16 644.32 cm-1 View
- 17 767.46 cm-1 View
- 18 789.45 cm-1 View
- 19 837.78 cm-1 View
- 20 859.77 cm-1 View
- 21 936.95 cm-1 View
- 22 951.97 cm-1 View
- 23 953.01 cm-1 View
- 24 963.04 cm-1 View
- 25 979.87 cm-1 View
- 26 982.49 cm-1 View
- 27 999.48 cm-1 View
- 28 1013.03 cm-1 View
- 29 1022.51 cm-1 View
- 30 1037.55 cm-1 View
- 31 1060.94 cm-1 View
- 32 1075.18 cm-1 View
- 33 1103.24 cm-1 View
- 34 1112.52 cm-1 View
- 35 1128.11 cm-1 View
- 36 1151.59 cm-1 View
- 37 1214.03 cm-1 View
- 38 1235.89 cm-1 View
- 39 1249.83 cm-1 View
- 40 1296.32 cm-1 View
- 41 1326.59 cm-1 View
- 42 1339.48 cm-1 View
- 43 1359.24 cm-1 View
- 44 1370.61 cm-1 View
- 45 1386.35 cm-1 View
- 46 1386.40 cm-1 View
- 47 1393.68 cm-1 View
- 48 1396.33 cm-1 View
- 49 1397.79 cm-1 View
- 50 1403.70 cm-1 View
- 51 1418.90 cm-1 View
- 52 1446.47 cm-1 View
- 53 1482.10 cm-1 View
- 54 1492.07 cm-1 View
- 55 1865.23 cm-1 View
- 56 1903.74 cm-1 View
- 57 2834.49 cm-1 View
- 58 2921.56 cm-1 View
- 59 2935.15 cm-1 View
- 60 2959.41 cm-1 View
- 61 3010.78 cm-1 View
- 62 3015.59 cm-1 View
- 63 3036.08 cm-1 View
- 64 3040.43 cm-1 View
- 65 3055.04 cm-1 View
- 66 3068.50 cm-1 View
- 67 3072.59 cm-1 View
- 68 3076.07 cm-1 View
- 69 3136.33 cm-1 View
- 70 3141.68 cm-1 View
- 71 3160.10 cm-1 View
- 72 3168.36 cm-1 View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | 21.45 | kJ mol-1 |
| Polar Solvation Energy | -3.65 | kJ mol-1 |
| Nonpolar Solvation Energy | 25.08 | kJ mol-1 |
| Surface Area | 128.35 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 0.45 | Debye |