1,4-dichlorobenzene

Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational222.08kJ mol-1
Total (Trans. + Rot. + Vib.)231.99kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational79.79J mol-1 K-1
Total (Trans. + Rot. + Vib.)113.04J mol-1 K-1
Entropy
PropertyValueUnit
Translational170.90J mol-1 K-1
Rotational122.52J mol-1 K-1
Vibrational57.87J mol-1 K-1
Total (Trans. + Rot. + Vib.)351.28J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation42.29kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 95.22 cm-1 View
  • 2 217.96 cm-1 View
  • 3 279.26 cm-1 View
  • 4 323.75 cm-1 View
  • 5 347.62 cm-1 View
  • 6 360.08 cm-1 View
  • 7 493.30 cm-1 View
  • 8 531.21 cm-1 View
  • 9 639.68 cm-1 View
  • 10 663.68 cm-1 View
  • 11 755.58 cm-1 View
  • 12 846.13 cm-1 View
  • 13 862.57 cm-1 View
  • 14 979.32 cm-1 View
  • 15 993.65 cm-1 View
  • 16 1006.66 cm-1 View
  • 17 1070.15 cm-1 View
  • 18 1112.46 cm-1 View
  • 19 1137.60 cm-1 View
  • 20 1197.59 cm-1 View
  • 21 1277.30 cm-1 View
  • 22 1316.55 cm-1 View
  • 23 1524.45 cm-1 View
  • 24 1542.24 cm-1 View
  • 25 1771.80 cm-1 View
  • 26 1775.56 cm-1 View
  • 27 3056.47 cm-1 View
  • 28 3057.96 cm-1 View
  • 29 3069.45 cm-1 View
  • 30 3073.11 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