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 | 495.42 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 505.34 | 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 | 130.70 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 163.96 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 170.02 | J mol-1 K-1 |
| Rotational | 123.25 | J mol-1 K-1 |
| Vibrational | 126.67 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 419.94 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -336.35 | kJ mol-1 |
Molecular Orbitals
- 1 -2818.49 eV View
- 2 -551.24 eV View
- 3 -302.30 eV View
- 4 -302.04 eV View
- 5 -301.08 eV View
- 6 -300.84 eV View
- 7 -300.54 eV View
- 8 -300.27 eV View
- 9 -279.84 eV View
- 10 -210.25 eV View
- 11 -210.10 eV View
- 12 -210.10 eV View
- 13 -35.44 eV View
- 14 -30.04 eV View
- 15 -27.59 eV View
- 16 -25.78 eV View
- 17 -25.13 eV View
- 18 -22.74 eV View
- 19 -21.71 eV View
- 20 -19.52 eV View
- 21 -17.34 eV View
- 22 -16.70 eV View
- 23 -16.30 eV View
- 24 -15.87 eV View
- 25 -14.88 eV View
- 26 -14.71 eV View
- 27 -14.20 eV View
- 28 -13.67 eV View
- 29 -13.17 eV View
- 30 -12.23 eV View
- 31 -12.14 eV View
- 32 -11.70 eV View
- 33 -11.49 eV View
- 34 -10.79 eV View
- 35 -9.67 eV View
- 36 -9.45 eV View
- 37 -9.38 eV View
- 38 10.44 eV View
- 39 14.74 eV View
- 40 15.00 eV View
- 41 16.14 eV View
- 42 16.76 eV View
- 43 17.19 eV View
- 44 17.91 eV View
- 45 18.24 eV View
- 46 18.27 eV View
- 47 18.88 eV View
- 48 19.39 eV View
- 49 19.43 eV View
- 50 19.81 eV View
- 51 20.23 eV View
- 52 20.46 eV View
- 53 20.94 eV View
- 54 21.55 eV View
- 55 21.77 eV View
- 56 22.29 eV View
- 57 22.69 eV View