Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational437.07kJ mol-1
Total (Trans. + Rot. + Vib.)446.98kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational103.43J mol-1 K-1
Total (Trans. + Rot. + Vib.)136.69J mol-1 K-1
Entropy
PropertyValueUnit
Translational167.93J mol-1 K-1
Rotational121.37J mol-1 K-1
Vibrational100.70J mol-1 K-1
Total (Trans. + Rot. + Vib.)390.00J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation-590.42kJ mol-1

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy-282.86kJ mol-1
Polar Solvation Energy-303.76kJ mol-1
Nonpolar Solvation Energy20.90kJ mol-1
Surface Area126.53Å2
Charge of Molecule-1
Dipole14.94Debye