Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational88.79kJ mol-1
Total (Trans. + Rot. + Vib.)98.71kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational46.34J mol-1 K-1
Total (Trans. + Rot. + Vib.)79.60J mol-1 K-1
Entropy
PropertyValueUnit
Translational164.01J mol-1 K-1
Rotational105.81J mol-1 K-1
Vibrational28.65J mol-1 K-1
Total (Trans. + Rot. + Vib.)298.47J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation2318.62kJ mol-1

Molecular Orbitals


Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy11.10kJ mol-1
Polar Solvation Energy-2.75kJ mol-1
Nonpolar Solvation Energy13.84kJ mol-1
Surface Area99.07Å2
Charge of Molecule0
Dipole0.39Debye