Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational445.08kJ mol-1
Total (Trans. + Rot. + Vib.)454.99kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational116.53J mol-1 K-1
Total (Trans. + Rot. + Vib.)149.79J mol-1 K-1
Entropy
PropertyValueUnit
Translational167.38J mol-1 K-1
Rotational119.41J mol-1 K-1
Vibrational107.49J mol-1 K-1
Total (Trans. + Rot. + Vib.)394.28J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation515.54kJ mol-1

Molecular Orbitals