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 | 288.45 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 298.36 | 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 | 74.00 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 107.25 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 164.16 | J mol-1 K-1 |
| Rotational | 112.70 | J mol-1 K-1 |
| Vibrational | 71.19 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 348.05 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -112.72 | kJ mol-1 |
Molecular Orbitals
- 1 -551.85 eV View
- 2 -417.37 eV View
- 3 -302.43 eV View
- 4 -301.10 eV View
- 5 -300.84 eV View
- 6 -299.48 eV View
- 7 -36.11 eV View
- 8 -31.36 eV View
- 9 -27.65 eV View
- 10 -24.22 eV View
- 11 -20.17 eV View
- 12 -19.92 eV View
- 13 -17.35 eV View
- 14 -16.31 eV View
- 15 -16.07 eV View
- 16 -14.70 eV View
- 17 -14.14 eV View
- 18 -13.62 eV View
- 19 -12.53 eV View
- 20 -11.79 eV View
- 21 -10.96 eV View
- 22 -9.16 eV View
- 23 -6.78 eV View
- 24 7.97 eV View
- 25 9.04 eV View
- 26 15.50 eV View
- 27 17.12 eV View
- 28 17.42 eV View
- 29 17.95 eV View
- 30 19.05 eV View
- 31 19.51 eV View
- 32 19.58 eV View
- 33 20.65 eV View
- 34 21.26 eV View
- 35 25.32 eV View
- 36 26.82 eV View
- 37 28.41 eV View