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 | 599.54 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 609.45 | 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 | 113.68 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 146.94 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 167.61 | J mol-1 K-1 |
| Rotational | 119.08 | J mol-1 K-1 |
| Vibrational | 78.92 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 365.61 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -174.41 | kJ mol-1 |
Molecular Orbitals
- 1 -300.37 eV View
- 2 -300.28 eV View
- 3 -300.28 eV View
- 4 -300.28 eV View
- 5 -300.26 eV View
- 6 -300.20 eV View
- 7 -300.18 eV View
- 8 -300.11 eV View
- 9 -29.53 eV View
- 10 -27.50 eV View
- 11 -26.14 eV View
- 12 -25.28 eV View
- 13 -22.26 eV View
- 14 -21.43 eV View
- 15 -20.24 eV View
- 16 -19.46 eV View
- 17 -16.71 eV View
- 18 -16.00 eV View
- 19 -15.49 eV View
- 20 -15.15 eV View
- 21 -14.76 eV View
- 22 -14.48 eV View
- 23 -13.51 eV View
- 24 -13.16 eV View
- 25 -12.58 eV View
- 26 -12.20 eV View
- 27 -12.03 eV View
- 28 -11.94 eV View
- 29 -11.57 eV View
- 30 -11.09 eV View
- 31 -10.17 eV View
- 32 -10.11 eV View
- 33 14.96 eV View
- 34 15.62 eV View
- 35 16.47 eV View
- 36 16.62 eV View
- 37 17.05 eV View
- 38 17.66 eV View
- 39 17.81 eV View
- 40 18.67 eV View
- 41 18.74 eV View
- 42 19.08 eV View
- 43 19.50 eV View
- 44 19.99 eV View
- 45 20.19 eV View
- 46 20.37 eV View
- 47 20.69 eV View
- 48 20.94 eV View
- 49 21.21 eV View
- 50 21.49 eV View
- 51 21.84 eV View
- 52 21.96 eV View
- 53 22.36 eV View
- 54 22.72 eV View
- 55 22.93 eV View
- 56 23.50 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 112.91 cm-1 View
- 2 143.21 cm-1 View
- 3 222.31 cm-1 View
- 4 225.60 cm-1 View
- 5 256.10 cm-1 View
- 6 314.25 cm-1 View
- 7 386.43 cm-1 View
- 8 458.90 cm-1 View
- 9 469.52 cm-1 View
- 10 491.42 cm-1 View
- 11 587.59 cm-1 View
- 12 820.07 cm-1 View
- 13 832.62 cm-1 View
- 14 853.34 cm-1 View
- 15 911.34 cm-1 View
- 16 931.55 cm-1 View
- 17 946.76 cm-1 View
- 18 962.77 cm-1 View
- 19 986.46 cm-1 View
- 20 993.12 cm-1 View
- 21 1026.50 cm-1 View
- 22 1053.69 cm-1 View
- 23 1080.10 cm-1 View
- 24 1106.82 cm-1 View
- 25 1120.91 cm-1 View
- 26 1132.81 cm-1 View
- 27 1139.19 cm-1 View
- 28 1141.00 cm-1 View
- 29 1147.49 cm-1 View
- 30 1150.64 cm-1 View
- 31 1157.04 cm-1 View
- 32 1166.32 cm-1 View
- 33 1187.47 cm-1 View
- 34 1205.82 cm-1 View
- 35 1255.60 cm-1 View
- 36 1295.40 cm-1 View
- 37 1320.58 cm-1 View
- 38 1340.55 cm-1 View
- 39 1358.64 cm-1 View
- 40 1363.21 cm-1 View
- 41 1386.43 cm-1 View
- 42 1401.31 cm-1 View
- 43 1405.59 cm-1 View
- 44 1407.10 cm-1 View
- 45 1410.06 cm-1 View
- 46 1413.52 cm-1 View
- 47 1416.12 cm-1 View
- 48 1416.95 cm-1 View
- 49 1422.73 cm-1 View
- 50 1430.14 cm-1 View
- 51 2866.29 cm-1 View
- 52 2926.53 cm-1 View
- 53 2952.39 cm-1 View
- 54 2953.78 cm-1 View
- 55 2956.66 cm-1 View
- 56 2961.94 cm-1 View
- 57 2967.52 cm-1 View
- 58 3010.25 cm-1 View
- 59 3031.96 cm-1 View
- 60 3033.35 cm-1 View
- 61 3036.08 cm-1 View
- 62 3039.98 cm-1 View
- 63 3042.65 cm-1 View
- 64 3044.15 cm-1 View
- 65 3088.15 cm-1 View
- 66 3169.48 cm-1 View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | 24.70 | kJ mol-1 |
| Polar Solvation Energy | -0.88 | kJ mol-1 |
| Nonpolar Solvation Energy | 25.58 | kJ mol-1 |
| Surface Area | 111.40 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 0.05 | Debye |