Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational2.48kJ mol-1
Vibrational22.77kJ mol-1
Total (Trans. + Rot. + Vib.)31.45kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational8.31J mol-1 K-1
Vibrational21.61J mol-1 K-1
Total (Trans. + Rot. + Vib.)50.71J mol-1 K-1
Entropy
PropertyValueUnit
Translational157.28J mol-1 K-1
Rotational67.40J mol-1 K-1
Vibrational22.66J mol-1 K-1
Total (Trans. + Rot. + Vib.)247.34J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation161.43kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy-52.43kJ mol-1
Polar Solvation Energy-84.04kJ mol-1
Nonpolar Solvation Energy31.60kJ mol-1
Surface Area111.37Å2
Charge of Molecule0
Dipole11.04Debye