Benzenesulfonic acid

Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational308.89kJ mol-1
Total (Trans. + Rot. + Vib.)318.81kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational122.43J mol-1 K-1
Total (Trans. + Rot. + Vib.)155.68J mol-1 K-1
Entropy
PropertyValueUnit
Translational171.88J mol-1 K-1
Rotational124.39J mol-1 K-1
Vibrational107.46J mol-1 K-1
Total (Trans. + Rot. + Vib.)403.73J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation-402.25kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 33.42 cm-1 View
  • 2 111.50 cm-1 View
  • 3 169.50 cm-1 View
  • 4 182.79 cm-1 View
  • 5 238.08 cm-1 View
  • 6 284.27 cm-1 View
  • 7 305.95 cm-1 View
  • 8 350.63 cm-1 View
  • 9 379.54 cm-1 View
  • 10 399.52 cm-1 View
  • 11 487.34 cm-1 View
  • 12 496.91 cm-1 View
  • 13 627.92 cm-1 View
  • 14 660.29 cm-1 View
  • 15 677.71 cm-1 View
  • 16 727.44 cm-1 View
  • 17 777.72 cm-1 View
  • 18 853.23 cm-1 View
  • 19 879.97 cm-1 View
  • 20 902.81 cm-1 View
  • 21 956.06 cm-1 View
  • 22 986.85 cm-1 View
  • 23 1003.12 cm-1 View
  • 24 1029.71 cm-1 View
  • 25 1086.36 cm-1 View
  • 26 1098.60 cm-1 View
  • 27 1107.46 cm-1 View
  • 28 1153.12 cm-1 View
  • 29 1159.75 cm-1 View
  • 30 1220.22 cm-1 View
  • 31 1258.01 cm-1 View
  • 32 1316.42 cm-1 View
  • 33 1529.20 cm-1 View
  • 34 1553.48 cm-1 View
  • 35 1770.07 cm-1 View
  • 36 1787.49 cm-1 View
  • 37 3025.78 cm-1 View
  • 38 3028.65 cm-1 View
  • 39 3053.90 cm-1 View
  • 40 3063.86 cm-1 View
  • 41 3074.81 cm-1 View
  • 42 3903.29 cm-1 View

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy-33.83kJ mol-1
Polar Solvation Energy-48.22kJ mol-1
Nonpolar Solvation Energy14.38kJ mol-1
Surface Area133.51Å2
Charge of Molecule0
Dipole5.14Debye