Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational27.93kJ mol-1
Total (Trans. + Rot. + Vib.)37.85kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational59.58J mol-1 K-1
Total (Trans. + Rot. + Vib.)92.83J mol-1 K-1
Entropy
PropertyValueUnit
Translational171.47J mol-1 K-1
Rotational121.37J mol-1 K-1
Vibrational74.47J mol-1 K-1
Total (Trans. + Rot. + Vib.)367.31J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation-581.45kJ mol-1

Vibrational Frequencies


Vibration
Vectors
Balls

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy-180.31kJ mol-1
Polar Solvation Energy-232.09kJ mol-1
Nonpolar Solvation Energy51.75kJ mol-1
Surface Area139.09Å2
Charge of Molecule-1
Dipole1.16Debye