2,2-difluoroethanol

Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational175.83kJ mol-1
Total (Trans. + Rot. + Vib.)185.75kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational48.26J mol-1 K-1
Total (Trans. + Rot. + Vib.)81.52J mol-1 K-1
Entropy
PropertyValueUnit
Translational163.71J mol-1 K-1
Rotational107.38J mol-1 K-1
Vibrational39.82J mol-1 K-1
Total (Trans. + Rot. + Vib.)310.91J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation-629.18kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 69.99 cm-1 View
  • 2 272.71 cm-1 View
  • 3 328.33 cm-1 View
  • 4 444.89 cm-1 View
  • 5 502.50 cm-1 View
  • 6 589.05 cm-1 View
  • 7 907.44 cm-1 View
  • 8 981.87 cm-1 View
  • 9 1038.72 cm-1 View
  • 10 1076.84 cm-1 View
  • 11 1121.64 cm-1 View
  • 12 1137.89 cm-1 View
  • 13 1319.95 cm-1 View
  • 14 1369.97 cm-1 View
  • 15 1382.34 cm-1 View
  • 16 1469.90 cm-1 View
  • 17 1547.20 cm-1 View
  • 18 2851.25 cm-1 View
  • 19 2958.07 cm-1 View
  • 20 3036.60 cm-1 View
  • 21 3882.23 cm-1 View

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy0.31kJ mol-1
Polar Solvation Energy-21.00kJ mol-1
Nonpolar Solvation Energy21.32kJ mol-1
Surface Area76.90Å2
Charge of Molecule0
Dipole2.86Debye