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 | 29.76 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 39.67 | 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 | 26.55 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 59.80 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 162.91 | J mol-1 K-1 |
| Rotational | 95.61 | J mol-1 K-1 |
| Vibrational | 22.42 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 280.95 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -235.51 | kJ mol-1 |
Molecular Orbitals
- 1 -2820.52 eV View
- 2 -2473.37 eV View
- 3 -281.65 eV View
- 4 -238.71 eV View
- 5 -212.02 eV View
- 6 -211.92 eV View
- 7 -211.92 eV View
- 8 -174.39 eV View
- 9 -174.32 eV View
- 10 -174.24 eV View
- 11 -125.18 eV View
- 12 -27.82 eV View
- 13 -24.86 eV View
- 14 -14.00 eV View
- 15 -13.25 eV View
- 16 -11.67 eV View
- 17 -11.53 eV View
- 18 -10.73 eV View
- 19 -9.12 eV View
- 20 5.79 eV View
- 21 6.41 eV View
- 22 8.44 eV View
- 23 12.98 eV View
- 24 19.82 eV View
Vibrational Frequencies
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| Balls |
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