1,2,4,5-tetrafluorobenzene
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 | 200.86 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 210.78 | 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 | 90.30 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 123.56 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 171.24 | J mol-1 K-1 |
| Rotational | 124.22 | J mol-1 K-1 |
| Vibrational | 65.71 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 361.17 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -616.47 | kJ mol-1 |
Molecular Orbitals
- 1 -707.04 eV View
- 2 -707.04 eV View
- 3 -707.04 eV View
- 4 -707.04 eV View
- 5 -302.87 eV View
- 6 -302.86 eV View
- 7 -302.86 eV View
- 8 -302.86 eV View
- 9 -301.02 eV View
- 10 -301.01 eV View
- 11 -42.00 eV View
- 12 -41.98 eV View
- 13 -41.60 eV View
- 14 -41.59 eV View
- 15 -30.31 eV View
- 16 -26.82 eV View
- 17 -25.95 eV View
- 18 -22.37 eV View
- 19 -21.06 eV View
- 20 -18.62 eV View
- 21 -18.11 eV View
- 22 -17.15 eV View
- 23 -16.60 eV View
- 24 -15.80 eV View
- 25 -15.69 eV View
- 26 -15.66 eV View
- 27 -15.35 eV View
- 28 -15.13 eV View
- 29 -14.91 eV View
- 30 -14.64 eV View
- 31 -14.15 eV View
- 32 -12.84 eV View
- 33 -11.77 eV View
- 34 -11.67 eV View
- 35 -11.10 eV View
- 36 -8.17 eV View
- 37 -6.89 eV View
- 38 6.35 eV View
- 39 6.63 eV View
- 40 12.70 eV View
- 41 13.11 eV View
- 42 14.64 eV View
- 43 15.79 eV View
- 44 17.04 eV View
- 45 17.57 eV View
- 46 18.66 eV View
- 47 21.83 eV View
- 48 22.77 eV View
- 49 23.21 eV View
- 50 23.29 eV View
- 51 28.16 eV View
- 52 29.61 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|
- 1 107.41 cm-1 View
- 2 184.94 cm-1 View
- 3 260.55 cm-1 View
- 4 332.54 cm-1 View
- 5 353.14 cm-1 View
- 6 375.78 cm-1 View
- 7 424.02 cm-1 View
- 8 436.39 cm-1 View
- 9 440.83 cm-1 View
- 10 517.11 cm-1 View
- 11 672.79 cm-1 View
- 12 704.46 cm-1 View
- 13 707.66 cm-1 View
- 14 718.88 cm-1 View
- 15 883.66 cm-1 View
- 16 942.62 cm-1 View
- 17 948.94 cm-1 View
- 18 1020.99 cm-1 View
- 19 1209.11 cm-1 View
- 20 1266.63 cm-1 View
- 21 1289.59 cm-1 View
- 22 1400.38 cm-1 View
- 23 1458.72 cm-1 View
- 24 1682.32 cm-1 View
- 25 1713.68 cm-1 View
- 26 1760.25 cm-1 View
- 27 1787.78 cm-1 View
- 28 1836.59 cm-1 View
- 29 3064.00 cm-1 View
- 30 3065.28 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 |