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 | 204.88 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 214.80 | 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 | 68.69 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 101.95 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 163.24 | J mol-1 K-1 |
| Rotational | 106.21 | J mol-1 K-1 |
| Vibrational | 70.18 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 339.63 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -167.54 | kJ mol-1 |
Molecular Orbitals
- 1 -552.78 eV View
- 2 -552.75 eV View
- 3 -552.59 eV View
- 4 -421.38 eV View
- 5 -302.13 eV View
- 6 -39.72 eV View
- 7 -35.15 eV View
- 8 -35.13 eV View
- 9 -25.84 eV View
- 10 -22.89 eV View
- 11 -18.24 eV View
- 12 -17.24 eV View
- 13 -16.88 eV View
- 14 -15.48 eV View
- 15 -14.87 eV View
- 16 -13.89 eV View
- 17 -12.76 eV View
- 18 -11.03 eV View
- 19 -10.72 eV View
- 20 -9.84 eV View
- 21 -8.80 eV View
- 22 13.57 eV View
- 23 14.96 eV View
- 24 15.03 eV View
- 25 16.82 eV View
- 26 18.02 eV View
- 27 18.24 eV View
- 28 18.85 eV View
- 29 19.03 eV View
- 30 20.51 eV View