2-chloropyrimidine-5-carbonyl chloride

Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational189.09kJ mol-1
Total (Trans. + Rot. + Vib.)199.01kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational100.43J mol-1 K-1
Total (Trans. + Rot. + Vib.)133.68J mol-1 K-1
Entropy
PropertyValueUnit
Translational173.23J mol-1 K-1
Rotational128.48J mol-1 K-1
Vibrational100.13J mol-1 K-1
Total (Trans. + Rot. + Vib.)401.84J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation-40.50kJ mol-1

Molecular Orbitals