Isocyanic acid
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 | 55.29 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 65.21 | 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 | 13.35 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 46.60 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 155.66 | J mol-1 K-1 |
| Rotational | 78.56 | J mol-1 K-1 |
| Vibrational | 6.66 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 240.87 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -63.90 | kJ mol-1 |
Molecular Orbitals
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | -12.16 | kJ mol-1 |
| Polar Solvation Energy | -16.58 | kJ mol-1 |
| Nonpolar Solvation Energy | 4.43 | kJ mol-1 |
| Surface Area | 64.94 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 2.33 | Debye |