Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational455.52kJ mol-1
Total (Trans. + Rot. + Vib.)465.44kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational126.36J mol-1 K-1
Total (Trans. + Rot. + Vib.)159.62J mol-1 K-1
Entropy
PropertyValueUnit
Translational170.02J mol-1 K-1
Rotational124.95J mol-1 K-1
Vibrational106.16J mol-1 K-1
Total (Trans. + Rot. + Vib.)401.12J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation57.71kJ mol-1

Molecular Orbitals