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 | 499.35 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 509.26 | 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 | 105.58 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 138.83 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 170.39 | J mol-1 K-1 |
| Rotational | 118.88 | J mol-1 K-1 |
| Vibrational | 44.63 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 333.89 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | 101.05 | kJ mol-1 |
Aqueous Solvation Energy at 298.15 K
| Surface |
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| Dipole |
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| Translucent Molecule |
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| Property | Value | Unit |
| Total Solvation Energy | -11.63 | kJ mol-1 |
| Polar Solvation Energy | -20.47 | kJ mol-1 |
| Nonpolar Solvation Energy | 8.86 | kJ mol-1 |
| Surface Area | 107.52 | Å2 |
| Charge of Molecule | 0 | |
| Dipole | 0.03 | Debye |