1,1,2,3,3,3-hexafluoroprop-1-ene
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 | 114.02 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 123.93 | 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 | 83.88 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 117.14 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 171.24 | J mol-1 K-1 |
| Rotational | 121.78 | J mol-1 K-1 |
| Vibrational | 81.22 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 374.24 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -1155.26 | kJ mol-1 |
Molecular Orbitals
- 1 -708.39 eV View
- 2 -708.34 eV View
- 3 -707.61 eV View
- 4 -706.98 eV View
- 5 -706.81 eV View
- 6 -706.81 eV View
- 7 -307.44 eV View
- 8 -305.61 eV View
- 9 -302.99 eV View
- 10 -44.18 eV View
- 11 -44.01 eV View
- 12 -42.31 eV View
- 13 -42.05 eV View
- 14 -41.26 eV View
- 15 -41.17 eV View
- 16 -27.99 eV View
- 17 -23.87 eV View
- 18 -20.75 eV View
- 19 -19.72 eV View
- 20 -18.76 eV View
- 21 -18.56 eV View
- 22 -17.86 eV View
- 23 -17.72 eV View
- 24 -16.79 eV View
- 25 -15.53 eV View
- 26 -15.06 eV View
- 27 -14.67 eV View
- 28 -14.28 eV View
- 29 -14.21 eV View
- 30 -14.08 eV View
- 31 -13.96 eV View
- 32 -13.30 eV View
- 33 -12.83 eV View
- 34 -12.81 eV View
- 35 -11.32 eV View
- 36 -8.17 eV View
- 37 6.91 eV View
- 38 12.01 eV View
- 39 14.55 eV View
- 40 14.91 eV View
- 41 16.32 eV View
- 42 17.43 eV View
- 43 18.16 eV View
- 44 22.52 eV View
- 45 25.39 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 36.05 cm-1 View
- 2 129.06 cm-1 View
- 3 199.91 cm-1 View
- 4 252.88 cm-1 View
- 5 294.55 cm-1 View
- 6 361.29 cm-1 View
- 7 389.41 cm-1 View
- 8 432.05 cm-1 View
- 9 485.47 cm-1 View
- 10 527.79 cm-1 View
- 11 581.54 cm-1 View
- 12 641.81 cm-1 View
- 13 701.61 cm-1 View
- 14 830.38 cm-1 View
- 15 1247.34 cm-1 View
- 16 1433.25 cm-1 View
- 17 1553.79 cm-1 View
- 18 1561.51 cm-1 View
- 19 1586.43 cm-1 View
- 20 1676.58 cm-1 View
- 21 1976.04 cm-1 View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | 0.00 | kJ mol-1 |
| Polar Solvation Energy | 0.00 | kJ mol-1 |
| Nonpolar Solvation Energy | 0.00 | kJ mol-1 |
| Surface Area | Å2 | |
| Charge of Molecule | 0 | |
| Dipole | 0.00 | Debye |