Propa-1,2-diene
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 | 145.78 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 155.70 | 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 | 25.14 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 58.40 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 154.76 | J mol-1 K-1 |
| Rotational | 87.11 | J mol-1 K-1 |
| Vibrational | 12.23 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 254.11 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | 196.75 | kJ mol-1 |
Molecular Orbitals
- 1 -300.13 eV View
- 2 -299.98 eV View
- 3 -299.98 eV View
- 4 -27.55 eV View
- 5 -24.42 eV View
- 6 -18.05 eV View
- 7 -15.39 eV View
- 8 -15.27 eV View
- 9 -15.27 eV View
- 10 -8.73 eV View
- 11 -8.73 eV View
- 12 8.58 eV View
- 13 8.58 eV View
- 14 17.94 eV View
- 15 19.07 eV View
- 16 21.89 eV View
- 17 22.27 eV View
- 18 22.28 eV View
- 19 35.71 eV View