Ethylcyclohexane
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 | 599.36 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 609.28 | 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 | 112.98 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 146.24 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 167.61 | J mol-1 K-1 |
| Rotational | 118.55 | J mol-1 K-1 |
| Vibrational | 78.39 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 364.54 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -170.51 | kJ mol-1 |
Molecular Orbitals
- 1 -300.38 eV View
- 2 -300.28 eV View
- 3 -300.28 eV View
- 4 -300.27 eV View
- 5 -300.26 eV View
- 6 -300.20 eV View
- 7 -300.18 eV View
- 8 -300.13 eV View
- 9 -29.53 eV View
- 10 -27.41 eV View
- 11 -26.16 eV View
- 12 -25.36 eV View
- 13 -22.24 eV View
- 14 -21.44 eV View
- 15 -20.80 eV View
- 16 -18.55 eV View
- 17 -16.94 eV View
- 18 -16.23 eV View
- 19 -15.59 eV View
- 20 -15.17 eV View
- 21 -14.82 eV View
- 22 -14.08 eV View
- 23 -13.38 eV View
- 24 -13.21 eV View
- 25 -12.98 eV View
- 26 -12.42 eV View
- 27 -12.09 eV View
- 28 -11.81 eV View
- 29 -11.55 eV View
- 30 -10.57 eV View
- 31 -10.29 eV View
- 32 -10.17 eV View
- 33 15.02 eV View
- 34 15.56 eV View
- 35 16.25 eV View
- 36 16.65 eV View
- 37 17.37 eV View
- 38 17.47 eV View
- 39 17.82 eV View
- 40 18.16 eV View
- 41 18.66 eV View
- 42 19.04 eV View
- 43 19.34 eV View
- 44 19.66 eV View
- 45 20.11 eV View
- 46 20.40 eV View
- 47 20.85 eV View
- 48 21.03 eV View
- 49 21.31 eV View
- 50 21.86 eV View
- 51 22.00 eV View
- 52 22.22 eV View
- 53 22.57 eV View
- 54 22.66 eV View
- 55 22.91 eV View
- 56 23.67 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 105.95 cm-1 View
- 2 147.93 cm-1 View
- 3 180.44 cm-1 View
- 4 235.55 cm-1 View
- 5 291.89 cm-1 View
- 6 346.29 cm-1 View
- 7 393.44 cm-1 View
- 8 424.71 cm-1 View
- 9 486.15 cm-1 View
- 10 525.57 cm-1 View
- 11 651.76 cm-1 View
- 12 818.23 cm-1 View
- 13 827.51 cm-1 View
- 14 852.79 cm-1 View
- 15 904.04 cm-1 View
- 16 931.90 cm-1 View
- 17 945.12 cm-1 View
- 18 952.27 cm-1 View
- 19 966.24 cm-1 View
- 20 984.37 cm-1 View
- 21 1040.49 cm-1 View
- 22 1047.40 cm-1 View
- 23 1064.08 cm-1 View
- 24 1090.10 cm-1 View
- 25 1103.26 cm-1 View
- 26 1113.78 cm-1 View
- 27 1120.10 cm-1 View
- 28 1136.09 cm-1 View
- 29 1145.33 cm-1 View
- 30 1155.84 cm-1 View
- 31 1158.98 cm-1 View
- 32 1172.47 cm-1 View
- 33 1189.20 cm-1 View
- 34 1241.92 cm-1 View
- 35 1260.99 cm-1 View
- 36 1308.49 cm-1 View
- 37 1318.61 cm-1 View
- 38 1342.21 cm-1 View
- 39 1357.46 cm-1 View
- 40 1364.79 cm-1 View
- 41 1375.04 cm-1 View
- 42 1396.64 cm-1 View
- 43 1398.48 cm-1 View
- 44 1407.34 cm-1 View
- 45 1411.61 cm-1 View
- 46 1413.90 cm-1 View
- 47 1416.25 cm-1 View
- 48 1418.36 cm-1 View
- 49 1422.75 cm-1 View
- 50 1441.53 cm-1 View
- 51 2860.37 cm-1 View
- 52 2924.17 cm-1 View
- 53 2946.63 cm-1 View
- 54 2950.26 cm-1 View
- 55 2952.39 cm-1 View
- 56 2957.82 cm-1 View
- 57 2965.52 cm-1 View
- 58 3010.16 cm-1 View
- 59 3028.36 cm-1 View
- 60 3029.60 cm-1 View
- 61 3034.41 cm-1 View
- 62 3037.29 cm-1 View
- 63 3042.97 cm-1 View
- 64 3043.99 cm-1 View
- 65 3086.98 cm-1 View
- 66 3169.37 cm-1 View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | 21.35 | kJ mol-1 |
| Polar Solvation Energy | -0.76 | kJ mol-1 |
| Nonpolar Solvation Energy | 22.11 | kJ mol-1 |
| Surface Area | 114.90 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 0.06 | Debye |