2,2,2-trifluoroethanamine
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 | 193.16 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 203.08 | 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 | 61.58 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 94.84 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 166.06 | J mol-1 K-1 |
| Rotational | 111.05 | J mol-1 K-1 |
| Vibrational | 49.74 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 326.84 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -686.84 | kJ mol-1 |
Molecular Orbitals
- 1 -706.16 eV View
- 2 -706.14 eV View
- 3 -706.08 eV View
- 4 -417.24 eV View
- 5 -306.52 eV View
- 6 -302.37 eV View
- 7 -43.48 eV View
- 8 -40.59 eV View
- 9 -40.52 eV View
- 10 -31.38 eV View
- 11 -25.49 eV View
- 12 -21.21 eV View
- 13 -18.50 eV View
- 14 -17.98 eV View
- 15 -17.65 eV View
- 16 -16.68 eV View
- 17 -15.45 eV View
- 18 -14.35 eV View
- 19 -13.55 eV View
- 20 -13.50 eV View
- 21 -12.67 eV View
- 22 -12.21 eV View
- 23 -12.17 eV View
- 24 -11.31 eV View
- 25 -9.32 eV View
- 26 14.13 eV View
- 27 14.75 eV View
- 28 15.84 eV View
- 29 17.75 eV View
- 30 18.14 eV View
- 31 18.62 eV View
- 32 19.18 eV View
- 33 20.01 eV View
- 34 21.24 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 89.36 cm-1 View
- 2 202.87 cm-1 View
- 3 253.11 cm-1 View
- 4 358.48 cm-1 View
- 5 400.66 cm-1 View
- 6 511.50 cm-1 View
- 7 526.57 cm-1 View
- 8 604.35 cm-1 View
- 9 866.21 cm-1 View
- 10 890.13 cm-1 View
- 11 1041.15 cm-1 View
- 12 1082.59 cm-1 View
- 13 1138.97 cm-1 View
- 14 1169.35 cm-1 View
- 15 1296.48 cm-1 View
- 16 1366.78 cm-1 View
- 17 1403.74 cm-1 View
- 18 1553.10 cm-1 View
- 19 1564.44 cm-1 View
- 20 1658.13 cm-1 View
- 21 2938.40 cm-1 View
- 22 3003.55 cm-1 View
- 23 3401.93 cm-1 View
- 24 3530.08 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 |