Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational33.83kJ mol-1
Total (Trans. + Rot. + Vib.)43.75kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational46.75J mol-1 K-1
Total (Trans. + Rot. + Vib.)80.01J mol-1 K-1
Entropy
PropertyValueUnit
Translational167.14J mol-1 K-1
Rotational106.31J mol-1 K-1
Vibrational33.35J mol-1 K-1
Total (Trans. + Rot. + Vib.)306.79J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation1578.41kJ mol-1

Molecular Orbitals


Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy-1047.96kJ mol-1
Polar Solvation Energy-1074.66kJ mol-1
Nonpolar Solvation Energy26.71kJ mol-1
Surface Area67.88Å2
Charge of Molecule2
Dipole0.02Debye