Benzene

Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational263.87kJ mol-1
Total (Trans. + Rot. + Vib.)273.79kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational48.69J mol-1 K-1
Total (Trans. + Rot. + Vib.)81.95J mol-1 K-1
Entropy
PropertyValueUnit
Translational163.09J mol-1 K-1
Rotational107.29J mol-1 K-1
Vibrational20.80J mol-1 K-1
Total (Trans. + Rot. + Vib.)291.18J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation98.08kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 355.67 cm-1 View
  • 2 356.35 cm-1 View
  • 3 619.03 cm-1 View
  • 4 620.46 cm-1 View
  • 5 620.53 cm-1 View
  • 6 714.90 cm-1 View
  • 7 850.05 cm-1 View
  • 8 850.11 cm-1 View
  • 9 975.94 cm-1 View
  • 10 978.02 cm-1 View
  • 11 978.19 cm-1 View
  • 12 1024.09 cm-1 View
  • 13 1068.67 cm-1 View
  • 14 1068.69 cm-1 View
  • 15 1147.79 cm-1 View
  • 16 1147.84 cm-1 View
  • 17 1154.23 cm-1 View
  • 18 1224.97 cm-1 View
  • 19 1229.57 cm-1 View
  • 20 1304.07 cm-1 View
  • 21 1547.51 cm-1 View
  • 22 1547.53 cm-1 View
  • 23 1785.48 cm-1 View
  • 24 1785.50 cm-1 View
  • 25 3055.42 cm-1 View
  • 26 3059.78 cm-1 View
  • 27 3059.86 cm-1 View
  • 28 3073.07 cm-1 View
  • 29 3073.14 cm-1 View
  • 30 3085.03 cm-1 View

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy1.89kJ mol-1
Polar Solvation Energy-4.89kJ mol-1
Nonpolar Solvation Energy6.73kJ mol-1
Surface Area93.41Å2
Charge of Molecule0
Dipole0.00Debye