(2s)-2-(chloromethyl)oxirane

Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational202.50kJ mol-1
Total (Trans. + Rot. + Vib.)212.41kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational48.89J mol-1 K-1
Total (Trans. + Rot. + Vib.)82.14J mol-1 K-1
Entropy
PropertyValueUnit
Translational165.14J mol-1 K-1
Rotational109.92J mol-1 K-1
Vibrational42.53J mol-1 K-1
Total (Trans. + Rot. + Vib.)317.59J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation-79.40kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 46.22 cm-1 View
  • 2 231.20 cm-1 View
  • 3 384.73 cm-1 View
  • 4 391.03 cm-1 View
  • 5 725.46 cm-1 View
  • 6 846.49 cm-1 View
  • 7 856.52 cm-1 View
  • 8 909.21 cm-1 View
  • 9 955.66 cm-1 View
  • 10 1010.69 cm-1 View
  • 11 1053.07 cm-1 View
  • 12 1114.82 cm-1 View
  • 13 1150.13 cm-1 View
  • 14 1165.69 cm-1 View
  • 15 1210.35 cm-1 View
  • 16 1260.12 cm-1 View
  • 17 1348.26 cm-1 View
  • 18 1382.53 cm-1 View
  • 19 1598.46 cm-1 View
  • 20 2953.57 cm-1 View
  • 21 3003.17 cm-1 View
  • 22 3040.62 cm-1 View
  • 23 3056.73 cm-1 View
  • 24 3060.47 cm-1 View

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy0.00kJ mol-1
Polar Solvation Energy0.00kJ mol-1
Nonpolar Solvation Energy0.00kJ mol-1
Surface AreaÅ2
Charge of Molecule0
Dipole0.00Debye