oxidane

Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational26.23kJ mol-1
Total (Trans. + Rot. + Vib.)36.15kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational4.45J mol-1 K-1
Total (Trans. + Rot. + Vib.)37.71J mol-1 K-1
Entropy
PropertyValueUnit
Translational158.02J mol-1 K-1
Rotational78.00J mol-1 K-1
Vibrational1.35J mol-1 K-1
Total (Trans. + Rot. + Vib.)237.37J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation44.00kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 764.82 cm-1 View
  • 2 1022.90 cm-1 View
  • 3 2544.10 cm-1 View

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy-63.87kJ mol-1
Polar Solvation Energy-82.48kJ mol-1
Nonpolar Solvation Energy18.60kJ mol-1
Surface Area65.53Å2
Charge of Molecule0
Dipole7.29Debye