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 | 323.84 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 333.75 | 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 | 106.15 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 139.41 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 169.07 | J mol-1 K-1 |
| Rotational | 121.98 | J mol-1 K-1 |
| Vibrational | 69.37 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 360.42 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | 654.82 | kJ mol-1 |
Molecular Orbitals
- 1 -300.77 eV View
- 2 -300.77 eV View
- 3 -300.76 eV View
- 4 -300.76 eV View
- 5 -300.75 eV View
- 6 -300.75 eV View
- 7 -299.81 eV View
- 8 -299.75 eV View
- 9 -299.55 eV View
- 10 -299.48 eV View
- 11 -29.31 eV View
- 12 -28.57 eV View
- 13 -27.35 eV View
- 14 -25.48 eV View
- 15 -25.43 eV View
- 16 -22.67 eV View
- 17 -21.59 eV View
- 18 -19.66 eV View
- 19 -17.56 eV View
- 20 -17.38 eV View
- 21 -17.11 eV View
- 22 -16.02 eV View
- 23 -14.44 eV View
- 24 -14.04 eV View
- 25 -13.75 eV View
- 26 -13.10 eV View
- 27 -12.95 eV View
- 28 -11.14 eV View
- 29 -11.09 eV View
- 30 -9.68 eV View
- 31 -7.59 eV View
- 32 -6.50 eV View
- 33 -6.00 eV View
- 34 4.17 eV View
- 35 5.58 eV View
- 36 8.79 eV View
- 37 9.94 eV View
- 38 10.71 eV View
- 39 13.93 eV View
- 40 15.61 eV View
- 41 16.14 eV View
- 42 16.54 eV View
- 43 17.22 eV View
- 44 17.59 eV View
- 45 19.56 eV View
- 46 19.81 eV View
- 47 20.77 eV View
- 48 21.73 eV View
- 49 21.99 eV View
- 50 23.71 eV View
- 51 26.37 eV View
- 52 27.17 eV View
- 53 27.18 eV View
- 54 28.65 eV View
- 55 41.03 eV View
- 56 41.47 eV View