Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational36.23kJ mol-1
Total (Trans. + Rot. + Vib.)46.15kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational41.44J mol-1 K-1
Total (Trans. + Rot. + Vib.)74.70J mol-1 K-1
Entropy
PropertyValueUnit
Translational165.66J mol-1 K-1
Rotational106.59J mol-1 K-1
Vibrational24.01J mol-1 K-1
Total (Trans. + Rot. + Vib.)296.27J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation-568.79kJ mol-1

Molecular Orbitals


Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy-999.11kJ mol-1
Polar Solvation Energy-1006.13kJ mol-1
Nonpolar Solvation Energy7.02kJ mol-1
Surface Area88.87Å2
Charge of Molecule-2
Dipole0.01Debye