Thiophene

Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational176.99kJ mol-1
Total (Trans. + Rot. + Vib.)186.91kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational39.23J mol-1 K-1
Total (Trans. + Rot. + Vib.)72.49J mol-1 K-1
Entropy
PropertyValueUnit
Translational164.01J mol-1 K-1
Rotational105.67J mol-1 K-1
Vibrational15.86J mol-1 K-1
Total (Trans. + Rot. + Vib.)285.54J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation128.41kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 384.07 cm-1 View
  • 2 497.16 cm-1 View
  • 3 595.09 cm-1 View
  • 4 688.52 cm-1 View
  • 5 750.77 cm-1 View
  • 6 790.40 cm-1 View
  • 7 797.27 cm-1 View
  • 8 875.86 cm-1 View
  • 9 934.39 cm-1 View
  • 10 982.14 cm-1 View
  • 11 1069.23 cm-1 View
  • 12 1075.86 cm-1 View
  • 13 1100.87 cm-1 View
  • 14 1191.97 cm-1 View
  • 15 1438.08 cm-1 View
  • 16 1597.56 cm-1 View
  • 17 1709.36 cm-1 View
  • 18 3116.36 cm-1 View
  • 19 3122.68 cm-1 View
  • 20 3138.73 cm-1 View
  • 21 3146.02 cm-1 View

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy-1.20kJ mol-1
Polar Solvation Energy-10.19kJ mol-1
Nonpolar Solvation Energy8.99kJ mol-1
Surface Area92.39Å2
Charge of Molecule0
Dipole1.23Debye