3-chloro-2,2,3,3-tetrafluoropropanoic acid
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 | 153.94 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 163.85 | 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 | 111.44 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 144.70 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 173.51 | J mol-1 K-1 |
| Rotational | 124.93 | J mol-1 K-1 |
| Vibrational | 114.36 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 412.80 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -1200.61 | kJ mol-1 |
Molecular Orbitals
- 1 -2820.29 eV View
- 2 -708.10 eV View
- 3 -708.00 eV View
- 4 -707.49 eV View
- 5 -707.48 eV View
- 6 -553.35 eV View
- 7 -552.53 eV View
- 8 -307.18 eV View
- 9 -306.40 eV View
- 10 -305.26 eV View
- 11 -281.54 eV View
- 12 -211.95 eV View
- 13 -211.79 eV View
- 14 -211.79 eV View
- 15 -44.19 eV View
- 16 -43.48 eV View
- 17 -41.94 eV View
- 18 -41.46 eV View
- 19 -38.79 eV View
- 20 -35.74 eV View
- 21 -29.44 eV View
- 22 -26.49 eV View
- 23 -23.26 eV View
- 24 -20.78 eV View
- 25 -19.56 eV View
- 26 -19.04 eV View
- 27 -18.20 eV View
- 28 -17.71 eV View
- 29 -17.25 eV View
- 30 -16.51 eV View
- 31 -15.75 eV View
- 32 -15.36 eV View
- 33 -14.88 eV View
- 34 -14.76 eV View
- 35 -14.43 eV View
- 36 -13.81 eV View
- 37 -13.36 eV View
- 38 -13.24 eV View
- 39 -12.68 eV View
- 40 -11.45 eV View
- 41 -11.07 eV View
- 42 -10.84 eV View
- 43 -10.30 eV View
- 44 -9.86 eV View
- 45 6.99 eV View
- 46 8.53 eV View
- 47 12.36 eV View
- 48 13.55 eV View
- 49 14.18 eV View
- 50 14.78 eV View
- 51 16.90 eV View
- 52 17.80 eV View
- 53 18.15 eV View
- 54 20.23 eV View
- 55 26.20 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 34.03 cm-1 View
- 2 54.54 cm-1 View
- 3 132.06 cm-1 View
- 4 177.50 cm-1 View
- 5 251.63 cm-1 View
- 6 294.15 cm-1 View
- 7 322.12 cm-1 View
- 8 334.27 cm-1 View
- 9 368.16 cm-1 View
- 10 427.38 cm-1 View
- 11 430.76 cm-1 View
- 12 485.53 cm-1 View
- 13 505.48 cm-1 View
- 14 551.04 cm-1 View
- 15 581.22 cm-1 View
- 16 657.16 cm-1 View
- 17 737.90 cm-1 View
- 18 881.67 cm-1 View
- 19 1036.63 cm-1 View
- 20 1257.88 cm-1 View
- 21 1418.03 cm-1 View
- 22 1426.16 cm-1 View
- 23 1473.63 cm-1 View
- 24 1547.26 cm-1 View
- 25 1560.60 cm-1 View
- 26 1989.65 cm-1 View
- 27 3845.65 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 |