Carbamoyl cyanide
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 | 124.94 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 134.85 | 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 | 39.21 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 72.47 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 161.73 | J mol-1 K-1 |
| Rotational | 105.41 | J mol-1 K-1 |
| Vibrational | 24.49 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 291.64 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -5.30 | kJ mol-1 |
Molecular Orbitals
- 1 -552.06 eV View
- 2 -418.94 eV View
- 3 -418.25 eV View
- 4 -305.38 eV View
- 5 -301.79 eV View
- 6 -37.01 eV View
- 7 -32.48 eV View
- 8 -31.46 eV View
- 9 -23.82 eV View
- 10 -19.38 eV View
- 11 -17.85 eV View
- 12 -15.16 eV View
- 13 -15.14 eV View
- 14 -13.74 eV View
- 15 -12.07 eV View
- 16 -11.75 eV View
- 17 -10.33 eV View
- 18 -9.18 eV View
- 19 5.94 eV View
- 20 8.73 eV View
- 21 11.81 eV View
- 22 14.36 eV View
- 23 16.12 eV View
- 24 19.26 eV View
- 25 21.67 eV View
- 26 26.48 eV View
- 27 35.71 eV View
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
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| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | -22.01 | kJ mol-1 |
| Polar Solvation Energy | -32.01 | kJ mol-1 |
| Nonpolar Solvation Energy | 9.99 | kJ mol-1 |
| Surface Area | 87.04 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 4.87 | Debye |