Chloro-trifluoromethane
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 | 47.40 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 57.32 | 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 | 34.59 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 67.85 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 166.66 | J mol-1 K-1 |
| Rotational | 109.50 | J mol-1 K-1 |
| Vibrational | 21.30 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 297.46 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -707.41 | kJ mol-1 |
Molecular Orbitals
- 1 -2820.44 eV View
- 2 -708.13 eV View
- 3 -708.12 eV View
- 4 -708.12 eV View
- 5 -308.85 eV View
- 6 -281.68 eV View
- 7 -212.09 eV View
- 8 -211.93 eV View
- 9 -211.93 eV View
- 10 -45.09 eV View
- 11 -42.19 eV View
- 12 -42.19 eV View
- 13 -28.99 eV View
- 14 -22.74 eV View
- 15 -19.25 eV View
- 16 -19.25 eV View
- 17 -18.78 eV View
- 18 -15.12 eV View
- 19 -15.12 eV View
- 20 -14.22 eV View
- 21 -13.78 eV View
- 22 -13.78 eV View
- 23 -11.93 eV View
- 24 -11.19 eV View
- 25 -11.19 eV View
- 26 8.28 eV View
- 27 14.88 eV View
- 28 14.88 eV View
- 29 17.04 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
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 |