Nitromethane
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 | 133.37 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 143.29 | 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 | 28.63 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 61.89 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 160.02 | J mol-1 K-1 |
| Rotational | 98.67 | J mol-1 K-1 |
| Vibrational | 25.96 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 284.65 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -66.59 | kJ mol-1 |
Molecular Orbitals
- 1 -551.46 eV View
- 2 -551.38 eV View
- 3 -426.34 eV View
- 4 -303.04 eV View
- 5 -41.66 eV View
- 6 -35.43 eV View
- 7 -28.07 eV View
- 8 -21.65 eV View
- 9 -18.33 eV View
- 10 -18.03 eV View
- 11 -16.95 eV View
- 12 -14.93 eV View
- 13 -14.88 eV View
- 14 -9.76 eV View
- 15 -9.65 eV View
- 16 -7.74 eV View
- 17 6.16 eV View
- 18 13.18 eV View
- 19 16.50 eV View
- 20 17.36 eV View
- 21 18.42 eV View
- 22 21.51 eV View
- 23 24.44 eV View
Vibrational Frequencies
| Vibration |
|
| Vectors |
|
| Balls |
|