Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational72.23kJ mol-1
Total (Trans. + Rot. + Vib.)82.15kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational12.27J mol-1 K-1
Total (Trans. + Rot. + Vib.)45.53J mol-1 K-1
Entropy
PropertyValueUnit
Translational151.97J mol-1 K-1
Rotational70.77J mol-1 K-1
Vibrational3.66J mol-1 K-1
Total (Trans. + Rot. + Vib.)226.40J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation52.18kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy19.37kJ mol-1
Polar Solvation Energy-1.54kJ mol-1
Nonpolar Solvation Energy20.90kJ mol-1
Surface Area67.09Å2
Charge of Molecule0
Dipole0.00Debye