Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational246.56kJ mol-1
Total (Trans. + Rot. + Vib.)256.47kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational58.39J mol-1 K-1
Total (Trans. + Rot. + Vib.)91.65J mol-1 K-1
Entropy
PropertyValueUnit
Translational165.54J mol-1 K-1
Rotational111.95J mol-1 K-1
Vibrational30.00J mol-1 K-1
Total (Trans. + Rot. + Vib.)307.49J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation114.23kJ mol-1

Molecular Orbitals


Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy-20.62kJ mol-1
Polar Solvation Energy-27.38kJ mol-1
Nonpolar Solvation Energy6.73kJ mol-1
Surface Area101.80Å2
Charge of Molecule0
Dipole5.11Debye