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 | 34.09 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 44.01 | 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 | 22.80 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 56.06 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 163.70 | J mol-1 K-1 |
| Rotational | 104.91 | J mol-1 K-1 |
| Vibrational | 16.15 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 284.76 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -105.74 | kJ mol-1 |
Molecular Orbitals
- 1 -2465.04 eV View
- 2 -1308.28 eV View
- 3 -411.58 eV View
- 4 -297.16 eV View
- 5 -230.91 eV View
- 6 -166.62 eV View
- 7 -166.46 eV View
- 8 -166.46 eV View
- 9 -90.32 eV View
- 10 -47.56 eV View
- 11 -47.41 eV View
- 12 -47.40 eV View
- 13 -26.83 eV View
- 14 -20.24 eV View
- 15 -10.37 eV View
- 16 -8.38 eV View
- 17 -7.93 eV View
- 18 -7.54 eV View
- 19 -2.33 eV View
- 20 -2.11 eV View
- 21 1.46 eV View
- 22 12.07 eV View
- 23 12.54 eV View
- 24 13.78 eV View
- 25 14.85 eV View
- 26 17.59 eV View
- 27 20.62 eV View
- 28 36.65 eV View