1,3,5-trichlorobenzene

Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational201.24kJ mol-1
Total (Trans. + Rot. + Vib.)211.15kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational95.52J mol-1 K-1
Total (Trans. + Rot. + Vib.)128.78J mol-1 K-1
Entropy
PropertyValueUnit
Translational173.51J mol-1 K-1
Rotational130.61J mol-1 K-1
Vibrational77.12J mol-1 K-1
Total (Trans. + Rot. + Vib.)381.23J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation16.65kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 133.13 cm-1 View
  • 2 184.49 cm-1 View
  • 3 185.14 cm-1 View
  • 4 185.79 cm-1 View
  • 5 185.89 cm-1 View
  • 6 372.62 cm-1 View
  • 7 422.07 cm-1 View
  • 8 422.11 cm-1 View
  • 9 424.62 cm-1 View
  • 10 530.27 cm-1 View
  • 11 530.58 cm-1 View
  • 12 628.19 cm-1 View
  • 13 788.28 cm-1 View
  • 14 788.30 cm-1 View
  • 15 925.15 cm-1 View
  • 16 925.23 cm-1 View
  • 17 955.11 cm-1 View
  • 18 1011.32 cm-1 View
  • 19 1088.12 cm-1 View
  • 20 1088.19 cm-1 View
  • 21 1183.05 cm-1 View
  • 22 1300.21 cm-1 View
  • 23 1323.22 cm-1 View
  • 24 1527.59 cm-1 View
  • 25 1527.63 cm-1 View
  • 26 1768.09 cm-1 View
  • 27 1768.25 cm-1 View
  • 28 3060.92 cm-1 View
  • 29 3061.08 cm-1 View
  • 30 3065.07 cm-1 View

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy39.89kJ mol-1
Polar Solvation Energy-5.15kJ mol-1
Nonpolar Solvation Energy45.06kJ mol-1
Surface Area161.08Å2
Charge of Molecule0
Dipole0.00Debye