(1r)-cyclohex-2-en-1-ol
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 | 399.85 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 409.76 | 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 | 82.70 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 115.96 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 165.94 | J mol-1 K-1 |
| Rotational | 113.71 | J mol-1 K-1 |
| Vibrational | 53.54 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 333.19 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -191.61 | kJ mol-1 |
Molecular Orbitals
- 1 -550.82 eV View
- 2 -301.84 eV View
- 3 -300.75 eV View
- 4 -300.68 eV View
- 5 -300.50 eV View
- 6 -300.00 eV View
- 7 -299.68 eV View
- 8 -35.15 eV View
- 9 -29.25 eV View
- 10 -26.34 eV View
- 11 -25.76 eV View
- 12 -21.82 eV View
- 13 -21.29 eV View
- 14 -18.12 eV View
- 15 -17.63 eV View
- 16 -16.20 eV View
- 17 -15.10 eV View
- 18 -14.94 eV View
- 19 -14.53 eV View
- 20 -13.98 eV View
- 21 -13.77 eV View
- 22 -12.16 eV View
- 23 -11.87 eV View
- 24 -11.46 eV View
- 25 -10.47 eV View
- 26 -9.18 eV View
- 27 -8.14 eV View
- 28 8.34 eV View
- 29 15.55 eV View
- 30 15.96 eV View
- 31 16.40 eV View
- 32 16.49 eV View
- 33 17.12 eV View
- 34 18.13 eV View
- 35 18.69 eV View
- 36 18.81 eV View
- 37 20.01 eV View
- 38 20.15 eV View
- 39 20.71 eV View
- 40 21.06 eV View
- 41 21.46 eV View
- 42 21.77 eV View
- 43 22.23 eV View
- 44 25.77 eV View
- 45 28.62 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 94.78 cm-1 View
- 2 237.99 cm-1 View
- 3 279.84 cm-1 View
- 4 355.50 cm-1 View
- 5 414.54 cm-1 View
- 6 478.96 cm-1 View
- 7 486.73 cm-1 View
- 8 581.94 cm-1 View
- 9 736.65 cm-1 View
- 10 771.46 cm-1 View
- 11 873.26 cm-1 View
- 12 908.86 cm-1 View
- 13 940.33 cm-1 View
- 14 958.99 cm-1 View
- 15 971.01 cm-1 View
- 16 1001.12 cm-1 View
- 17 1026.41 cm-1 View
- 18 1050.66 cm-1 View
- 19 1076.22 cm-1 View
- 20 1098.07 cm-1 View
- 21 1110.58 cm-1 View
- 22 1126.59 cm-1 View
- 23 1146.74 cm-1 View
- 24 1176.12 cm-1 View
- 25 1233.34 cm-1 View
- 26 1291.89 cm-1 View
- 27 1311.43 cm-1 View
- 28 1332.86 cm-1 View
- 29 1348.86 cm-1 View
- 30 1378.53 cm-1 View
- 31 1393.18 cm-1 View
- 32 1407.32 cm-1 View
- 33 1418.23 cm-1 View
- 34 1426.54 cm-1 View
- 35 1881.41 cm-1 View
- 36 2902.91 cm-1 View
- 37 2944.18 cm-1 View
- 38 2957.84 cm-1 View
- 39 2968.95 cm-1 View
- 40 3025.80 cm-1 View
- 41 3039.44 cm-1 View
- 42 3043.83 cm-1 View
- 43 3045.69 cm-1 View
- 44 3064.56 cm-1 View
- 45 3883.05 cm-1 View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | 8.26 | kJ mol-1 |
| Polar Solvation Energy | -10.20 | kJ mol-1 |
| Nonpolar Solvation Energy | 18.43 | kJ mol-1 |
| Surface Area | 98.65 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 2.21 | Debye |