Dioxiran-3-one

Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational38.65kJ mol-1
Total (Trans. + Rot. + Vib.)48.57kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational15.74J mol-1 K-1
Total (Trans. + Rot. + Vib.)49.00J mol-1 K-1
Entropy
PropertyValueUnit
Translational159.81J mol-1 K-1
Rotational96.16J mol-1 K-1
Vibrational7.13J mol-1 K-1
Total (Trans. + Rot. + Vib.)263.10J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation-142.17kJ mol-1

Molecular Orbitals


Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy-5.47kJ mol-1
Polar Solvation Energy-10.10kJ mol-1
Nonpolar Solvation Energy4.64kJ mol-1
Surface Area68.05Å2
Charge of Molecule0
Dipole0.80Debye