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 | 364.72 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 374.64 | 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 | 55.12 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 88.38 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 166.68 | J mol-1 K-1 |
| Rotational | 111.03 | J mol-1 K-1 |
| Vibrational | 15.77 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 293.48 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | 475.59 | kJ mol-1 |
Molecular Orbitals
- 1 -299.95 eV View
- 2 -299.95 eV View
- 3 -299.95 eV View
- 4 -299.95 eV View
- 5 -299.94 eV View
- 6 -299.94 eV View
- 7 -299.94 eV View
- 8 -299.93 eV View
- 9 -32.64 eV View
- 10 -25.43 eV View
- 11 -25.43 eV View
- 12 -25.43 eV View
- 13 -19.84 eV View
- 14 -19.84 eV View
- 15 -19.84 eV View
- 16 -18.40 eV View
- 17 -16.52 eV View
- 18 -14.77 eV View
- 19 -14.77 eV View
- 20 -14.77 eV View
- 21 -14.59 eV View
- 22 -14.59 eV View
- 23 -9.33 eV View
- 24 -9.33 eV View
- 25 -9.33 eV View
- 26 -9.25 eV View
- 27 -9.25 eV View
- 28 -9.25 eV View
- 29 12.91 eV View
- 30 12.91 eV View
- 31 12.91 eV View
- 32 15.31 eV View
- 33 15.31 eV View
- 34 15.31 eV View
- 35 15.61 eV View
- 36 19.26 eV View
- 37 19.26 eV View
- 38 19.26 eV View
- 39 19.33 eV View
- 40 19.33 eV View
- 41 19.33 eV View
- 42 19.53 eV View
- 43 19.86 eV View
- 44 19.86 eV View
- 45 23.72 eV View
- 46 23.72 eV View
- 47 23.72 eV View
- 48 31.85 eV View