2,2-dichloroacetic 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 | 123.30 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 133.21 | 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 | 63.40 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 96.66 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 169.25 | J mol-1 K-1 |
| Rotational | 117.61 | J mol-1 K-1 |
| Vibrational | 66.83 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 353.69 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -423.69 | kJ mol-1 |
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 24.34 cm-1 View
- 2 171.89 cm-1 View
- 3 213.57 cm-1 View
- 4 258.45 cm-1 View
- 5 412.08 cm-1 View
- 6 412.89 cm-1 View
- 7 540.62 cm-1 View
- 8 594.54 cm-1 View
- 9 726.22 cm-1 View
- 10 756.11 cm-1 View
- 11 958.56 cm-1 View
- 12 1152.28 cm-1 View
- 13 1182.20 cm-1 View
- 14 1315.82 cm-1 View
- 15 1431.27 cm-1 View
- 16 1994.79 cm-1 View
- 17 2951.09 cm-1 View
- 18 3867.42 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 |