Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational459.64kJ mol-1
Total (Trans. + Rot. + Vib.)469.55kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational128.12J mol-1 K-1
Total (Trans. + Rot. + Vib.)161.37J mol-1 K-1
Entropy
PropertyValueUnit
Translational168.97J mol-1 K-1
Rotational122.98J mol-1 K-1
Vibrational131.79J mol-1 K-1
Total (Trans. + Rot. + Vib.)423.75J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation191.84kJ mol-1

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy5.05kJ mol-1
Polar Solvation Energy-18.41kJ mol-1
Nonpolar Solvation Energy23.49kJ mol-1
Surface Area123.22Å2
Charge of Molecule0
Dipole0.67Debye