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 | 322.12 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 332.03 | 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 | 99.58 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 132.84 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 170.02 | J mol-1 K-1 |
| Rotational | 123.59 | J mol-1 K-1 |
| Vibrational | 80.52 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 374.13 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | -375.33 | kJ mol-1 |
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | -292.88 | kJ mol-1 |
| Polar Solvation Energy | -308.10 | kJ mol-1 |
| Nonpolar Solvation Energy | 15.17 | kJ mol-1 |
| Surface Area | 128.87 | Å2 |
| Charge of Molecule | -1 | |
| Dipole | 14.65 | Debye |