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 | 302.10 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 312.02 | 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 | 33.93 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 67.19 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 159.82 | J mol-1 K-1 |
| Rotational | 101.20 | J mol-1 K-1 |
| Vibrational | 18.42 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 279.44 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | 1789.46 | kJ mol-1 |
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | -874.92 | kJ mol-1 |
| Polar Solvation Energy | -889.14 | kJ mol-1 |
| Nonpolar Solvation Energy | 14.25 | kJ mol-1 |
| Surface Area | 82.48 | Å2 |
| Charge of Molecule | 2 | |
| Dipole | 0.01 | Debye |