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 | 77.30 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 87.21 | 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 | 7.94 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 41.19 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 142.54 | J mol-1 K-1 |
| Rotational | 58.35 | J mol-1 K-1 |
| Vibrational | 5.84 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 206.72 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | 215.33 | kJ mol-1 |
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | -336.09 | kJ mol-1 |
| Polar Solvation Energy | -342.13 | kJ mol-1 |
| Nonpolar Solvation Energy | 6.02 | kJ mol-1 |
| Surface Area | 48.03 | Å2 |
| Charge of Molecule | -1 | |
| Dipole | 1.72 | Debye |