Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational24.39kJ mol-1
Total (Trans. + Rot. + Vib.)34.31kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational28.93J mol-1 K-1
Total (Trans. + Rot. + Vib.)62.19J mol-1 K-1
Entropy
PropertyValueUnit
Translational168.34J mol-1 K-1
Rotational113.22J mol-1 K-1
Vibrational22.48J mol-1 K-1
Total (Trans. + Rot. + Vib.)304.03J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation-26.86kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy37.74kJ mol-1
Polar Solvation Energy-6.68kJ mol-1
Nonpolar Solvation Energy44.43kJ mol-1
Surface Area113.89Å2
Charge of Molecule0
Dipole1.50Debye