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 | 715.60 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 725.52 | 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 | 171.94 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 205.19 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 172.21 | J mol-1 K-1 |
| Rotational | 128.11 | J mol-1 K-1 |
| Vibrational | 154.25 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 454.57 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -212.35 | kJ mol-1 |
Molecular Orbitals
- 1 -2818.81 eV View
- 2 -302.05 eV View
- 3 -301.16 eV View
- 4 -300.55 eV View
- 5 -300.53 eV View
- 6 -300.52 eV View
- 7 -300.46 eV View
- 8 -300.37 eV View
- 9 -300.05 eV View
- 10 -299.98 eV View
- 11 -280.12 eV View
- 12 -210.53 eV View
- 13 -210.39 eV View
- 14 -210.39 eV View
- 15 -30.17 eV View
- 16 -28.18 eV View
- 17 -27.26 eV View
- 18 -26.51 eV View
- 19 -25.57 eV View
- 20 -23.37 eV View
- 21 -22.33 eV View
- 22 -21.85 eV View
- 23 -20.95 eV View
- 24 -18.91 eV View
- 25 -16.80 eV View
- 26 -16.52 eV View
- 27 -16.33 eV View
- 28 -16.03 eV View
- 29 -14.73 eV View
- 30 -14.53 eV View
- 31 -14.08 eV View
- 32 -14.03 eV View
- 33 -14.00 eV View
- 34 -13.43 eV View
- 35 -13.10 eV View
- 36 -12.81 eV View
- 37 -12.66 eV View
- 38 -12.42 eV View
- 39 -12.23 eV View
- 40 -11.39 eV View
- 41 -11.30 eV View
- 42 -10.79 eV View
- 43 -10.54 eV View
- 44 -9.44 eV View
- 45 -9.19 eV View
- 46 10.84 eV View
- 47 14.86 eV View
- 48 15.06 eV View
- 49 15.50 eV View
- 50 15.86 eV View
- 51 16.65 eV View
- 52 17.21 eV View
- 53 17.52 eV View
- 54 18.06 eV View
- 55 18.29 eV View
- 56 18.64 eV View
- 57 18.81 eV View
- 58 18.97 eV View
- 59 19.08 eV View
- 60 19.63 eV View
- 61 19.89 eV View
- 62 20.20 eV View
- 63 20.48 eV View
- 64 20.56 eV View
- 65 20.84 eV View
- 66 21.11 eV View
- 67 21.34 eV View
- 68 21.90 eV View
- 69 22.24 eV View
- 70 22.61 eV View
- 71 22.79 eV View
- 72 23.15 eV View
- 73 23.68 eV View