Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational363.30kJ mol-1
Total (Trans. + Rot. + Vib.)373.22kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational90.61J mol-1 K-1
Total (Trans. + Rot. + Vib.)123.87J mol-1 K-1
Entropy
PropertyValueUnit
Translational166.31J mol-1 K-1
Rotational117.59J mol-1 K-1
Vibrational97.21J mol-1 K-1
Total (Trans. + Rot. + Vib.)381.11J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation-569.70kJ mol-1

Molecular Orbitals


Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy-286.41kJ mol-1
Polar Solvation Energy-306.72kJ mol-1
Nonpolar Solvation Energy20.31kJ mol-1
Surface Area105.69Å2
Charge of Molecule-1
Dipole11.92Debye