Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational426.75kJ mol-1
Total (Trans. + Rot. + Vib.)436.67kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational129.45J mol-1 K-1
Total (Trans. + Rot. + Vib.)162.71J mol-1 K-1
Entropy
PropertyValueUnit
Translational169.46J mol-1 K-1
Rotational122.10J mol-1 K-1
Vibrational128.59J mol-1 K-1
Total (Trans. + Rot. + Vib.)420.14J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation-547.08kJ mol-1

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy-12.97kJ mol-1
Polar Solvation Energy-31.45kJ mol-1
Nonpolar Solvation Energy18.52kJ mol-1
Surface Area126.34Å2
Charge of Molecule0
Dipole5.49Debye