Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational284.12kJ mol-1
Total (Trans. + Rot. + Vib.)294.04kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational77.58J mol-1 K-1
Total (Trans. + Rot. + Vib.)110.84J mol-1 K-1
Entropy
PropertyValueUnit
Translational167.48J mol-1 K-1
Rotational116.41J mol-1 K-1
Vibrational57.83J mol-1 K-1
Total (Trans. + Rot. + Vib.)341.72J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation817.04kJ mol-1

Molecular Orbitals


Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy-197.39kJ mol-1
Polar Solvation Energy-208.46kJ mol-1
Nonpolar Solvation Energy11.08kJ mol-1
Surface Area114.29Å2
Charge of Molecule1
Dipole7.40Debye