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 | 382.56 | kJ mol-1 |
| Total (Trans. + Rot. + Vib.) | 392.48 | 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 | 66.49 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 99.74 | J mol-1 K-1 |
| Entropy | ||
| Property | Value | Unit |
| Translational | 164.60 | J mol-1 K-1 |
| Rotational | 109.73 | J mol-1 K-1 |
| Vibrational | 35.83 | J mol-1 K-1 |
| Total (Trans. + Rot. + Vib.) | 310.16 | J mol-1 K-1 |
| Other Properties | ||
| Property | Value | Unit |
| Heat of Formation | 489.64 | 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 | -226.13 | kJ mol-1 |
| Polar Solvation Energy | -240.66 | kJ mol-1 |
| Nonpolar Solvation Energy | 14.50 | kJ mol-1 |
| Surface Area | 93.75 | Å2 |
| Charge of Molecule | 1 | |
| Dipole | 7.36 | Debye |