Propanedinitrile
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 | 121.94 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 131.86 | 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 | 37.28 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 70.54 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 161.00 | J mol-1 K-1 |
| Rotational | 105.00 | J mol-1 K-1 |
| Vibrational | 24.95 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 290.95 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | 269.39 | kJ mol-1 |
Molecular Orbitals
- 1 -418.69 eV View
- 2 -418.69 eV View
- 3 -304.29 eV View
- 4 -301.95 eV View
- 5 -301.95 eV View
- 6 -32.73 eV View
- 7 -32.31 eV View
- 8 -28.56 eV View
- 9 -19.74 eV View
- 10 -18.48 eV View
- 11 -17.63 eV View
- 12 -13.72 eV View
- 13 -13.50 eV View
- 14 -12.21 eV View
- 15 -12.01 eV View
- 16 -11.67 eV View
- 17 -11.40 eV View
- 18 8.09 eV View
- 19 8.50 eV View
- 20 9.34 eV View
- 21 9.65 eV View
- 22 15.26 eV View
- 23 16.06 eV View
- 24 17.49 eV View
- 25 17.92 eV View
- 26 35.00 eV View
- 27 36.22 eV View