Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational36.38kJ mol-1
Total (Trans. + Rot. + Vib.)46.30kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational15.76J mol-1 K-1
Total (Trans. + Rot. + Vib.)49.02J mol-1 K-1
Entropy
PropertyValueUnit
Translational161.55J mol-1 K-1
Rotational98.84J mol-1 K-1
Vibrational7.37J mol-1 K-1
Total (Trans. + Rot. + Vib.)267.76J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation-747.40kJ mol-1

Molecular Orbitals


Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy-280.54kJ mol-1
Polar Solvation Energy-305.34kJ mol-1
Nonpolar Solvation Energy24.79kJ mol-1
Surface Area63.97Å2
Charge of Molecule-1
Dipole1.83Debye