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 | 477.89 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 487.81 | 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 | 120.58 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 153.84 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 170.11 | J mol-1 K-1 |
| Rotational | 124.34 | J mol-1 K-1 |
| Vibrational | 91.81 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 386.27 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | 149.62 | kJ mol-1 |
Aqueous Solvation Energy at 298.15 K
| Surface |
|
| Dipole |
|
| Translucent Molecule |
|
| Property | Value | Unit |
| Total Solvation Energy | -9.74 | kJ mol-1 |
| Polar Solvation Energy | -29.85 | kJ mol-1 |
| Nonpolar Solvation Energy | 20.11 | kJ mol-1 |
| Surface Area | 131.57 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 5.75 | Debye |