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 | 340.12 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 350.03 | 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 | 98.20 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 131.46 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 171.24 | J mol-1 K-1 |
| Rotational | 122.36 | J mol-1 K-1 |
| Vibrational | 75.55 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 369.14 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -68.22 | kJ mol-1 |
Molecular Orbitals
- 1 -2819.42 eV View
- 2 -2819.35 eV View
- 3 -303.89 eV View
- 4 -301.47 eV View
- 5 -301.23 eV View
- 6 -301.14 eV View
- 7 -300.81 eV View
- 8 -300.58 eV View
- 9 -280.70 eV View
- 10 -280.64 eV View
- 11 -211.12 eV View
- 12 -211.05 eV View
- 13 -210.96 eV View
- 14 -210.96 eV View
- 15 -210.90 eV View
- 16 -210.90 eV View
- 17 -31.56 eV View
- 18 -28.91 eV View
- 19 -27.08 eV View
- 20 -26.92 eV View
- 21 -25.28 eV View
- 22 -22.17 eV View
- 23 -21.27 eV View
- 24 -18.41 eV View
- 25 -17.56 eV View
- 26 -16.13 eV View
- 27 -15.57 eV View
- 28 -15.28 eV View
- 29 -14.69 eV View
- 30 -14.15 eV View
- 31 -13.83 eV View
- 32 -12.28 eV View
- 33 -12.14 eV View
- 34 -11.87 eV View
- 35 -10.43 eV View
- 36 -10.27 eV View
- 37 -9.77 eV View
- 38 -9.55 eV View
- 39 -8.58 eV View
- 40 7.10 eV View
- 41 9.62 eV View
- 42 11.34 eV View
- 43 15.30 eV View
- 44 15.83 eV View
- 45 16.31 eV View
- 46 16.98 eV View
- 47 17.71 eV View
- 48 18.13 eV View
- 49 19.19 eV View
- 50 19.63 eV View
- 51 19.79 eV View
- 52 20.57 eV View
- 53 20.72 eV View
- 54 21.53 eV View
- 55 25.10 eV View
- 56 27.66 eV View