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 | 342.82 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 352.73 | 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 | 86.48 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 119.74 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 167.14 | J mol-1 K-1 |
| Rotational | 116.69 | J mol-1 K-1 |
| Vibrational | 80.19 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 364.02 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -302.99 | kJ mol-1 |
Molecular Orbitals
- 1 -2818.78 eV View
- 2 -551.04 eV View
- 3 -302.20 eV View
- 4 -302.11 eV View
- 5 -301.06 eV View
- 6 -300.54 eV View
- 7 -280.09 eV View
- 8 -210.50 eV View
- 9 -210.36 eV View
- 10 -210.36 eV View
- 11 -35.35 eV View
- 12 -29.33 eV View
- 13 -27.02 eV View
- 14 -25.10 eV View
- 15 -22.20 eV View
- 16 -20.38 eV View
- 17 -17.55 eV View
- 18 -16.36 eV View
- 19 -15.55 eV View
- 20 -15.14 eV View
- 21 -14.71 eV View
- 22 -13.62 eV View
- 23 -13.23 eV View
- 24 -12.37 eV View
- 25 -11.89 eV View
- 26 -10.98 eV View
- 27 -9.80 eV View
- 28 -9.60 eV View
- 29 -9.38 eV View
- 30 10.73 eV View
- 31 14.76 eV View
- 32 15.57 eV View
- 33 16.96 eV View
- 34 17.49 eV View
- 35 17.85 eV View
- 36 18.74 eV View
- 37 19.50 eV View
- 38 19.68 eV View
- 39 20.00 eV View
- 40 20.45 eV View
- 41 20.75 eV View
- 42 20.91 eV View
- 43 21.88 eV View