1,2,4,5-tetrachlorobenzene
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 | 180.62 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 190.54 | 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 | 110.81 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 144.07 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 175.66 | J mol-1 K-1 |
| Rotational | 132.82 | J mol-1 K-1 |
| Vibrational | 101.82 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 410.29 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -1.78 | kJ mol-1 |
Molecular Orbitals
- 1 -2820.93 eV View
- 2 -2820.93 eV View
- 3 -2820.93 eV View
- 4 -2820.93 eV View
- 5 -302.97 eV View
- 6 -302.97 eV View
- 7 -302.96 eV View
- 8 -302.96 eV View
- 9 -301.91 eV View
- 10 -301.90 eV View
- 11 -282.08 eV View
- 12 -282.08 eV View
- 13 -282.07 eV View
- 14 -282.07 eV View
- 15 -212.50 eV View
- 16 -212.50 eV View
- 17 -212.50 eV View
- 18 -212.50 eV View
- 19 -212.34 eV View
- 20 -212.34 eV View
- 21 -212.33 eV View
- 22 -212.33 eV View
- 23 -212.33 eV View
- 24 -212.33 eV View
- 25 -212.32 eV View
- 26 -212.32 eV View
- 27 -32.83 eV View
- 28 -31.38 eV View
- 29 -30.06 eV View
- 30 -29.35 eV View
- 31 -28.08 eV View
- 32 -26.15 eV View
- 33 -24.59 eV View
- 34 -22.52 eV View
- 35 -20.43 eV View
- 36 -18.23 eV View
- 37 -17.46 eV View
- 38 -16.70 eV View
- 39 -15.62 eV View
- 40 -14.95 eV View
- 41 -14.55 eV View
- 42 -13.87 eV View
- 43 -13.56 eV View
- 44 -13.13 eV View
- 45 -12.43 eV View
- 46 -11.84 eV View
- 47 -11.28 eV View
- 48 -11.03 eV View
- 49 -10.87 eV View
- 50 -10.56 eV View
- 51 -10.44 eV View
- 52 -8.53 eV View
- 53 -7.66 eV View
- 54 5.52 eV View
- 55 5.64 eV View
- 56 9.23 eV View
- 57 10.57 eV View
- 58 11.57 eV View
- 59 11.85 eV View
- 60 13.41 eV View
- 61 16.48 eV View
- 62 17.81 eV View
- 63 20.14 eV View
- 64 21.63 eV View
- 65 21.79 eV View
- 66 22.20 eV View
- 67 27.43 eV View
- 68 28.22 eV View
Jmol._Canvas2D (JSmol) "jmol_orbitals"[x]
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 |
Jmol._Canvas2D (JSmol) "jmol_solvation"[x]