Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational73.62kJ mol-1
Total (Trans. + Rot. + Vib.)83.54kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational21.26J mol-1 K-1
Total (Trans. + Rot. + Vib.)54.51J mol-1 K-1
Entropy
PropertyValueUnit
Translational158.72J mol-1 K-1
Rotational95.54J mol-1 K-1
Vibrational12.93J mol-1 K-1
Total (Trans. + Rot. + Vib.)267.19J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation13.40kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy-15.98kJ mol-1
Polar Solvation Energy-21.84kJ mol-1
Nonpolar Solvation Energy5.89kJ mol-1
Surface Area78.07Å2
Charge of Molecule0
Dipole2.95Debye