Thiolane

Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational297.82kJ mol-1
Total (Trans. + Rot. + Vib.)307.74kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational54.95J mol-1 K-1
Total (Trans. + Rot. + Vib.)88.20J mol-1 K-1
Entropy
PropertyValueUnit
Translational164.59J mol-1 K-1
Rotational108.42J mol-1 K-1
Vibrational35.63J mol-1 K-1
Total (Trans. + Rot. + Vib.)308.64J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation-43.28kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 117.21 cm-1 View
  • 2 188.07 cm-1 View
  • 3 471.90 cm-1 View
  • 4 554.04 cm-1 View
  • 5 726.82 cm-1 View
  • 6 742.54 cm-1 View
  • 7 812.88 cm-1 View
  • 8 839.71 cm-1 View
  • 9 884.00 cm-1 View
  • 10 974.54 cm-1 View
  • 11 982.52 cm-1 View
  • 12 1022.15 cm-1 View
  • 13 1052.21 cm-1 View
  • 14 1073.78 cm-1 View
  • 15 1127.33 cm-1 View
  • 16 1129.36 cm-1 View
  • 17 1145.86 cm-1 View
  • 18 1212.80 cm-1 View
  • 19 1238.19 cm-1 View
  • 20 1301.16 cm-1 View
  • 21 1318.45 cm-1 View
  • 22 1381.42 cm-1 View
  • 23 1390.70 cm-1 View
  • 24 1408.82 cm-1 View
  • 25 1416.95 cm-1 View
  • 26 2962.16 cm-1 View
  • 27 2973.43 cm-1 View
  • 28 3003.78 cm-1 View
  • 29 3004.90 cm-1 View
  • 30 3049.61 cm-1 View
  • 31 3054.88 cm-1 View
  • 32 3080.59 cm-1 View
  • 33 3081.80 cm-1 View

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy-4.72kJ mol-1
Polar Solvation Energy-22.27kJ mol-1
Nonpolar Solvation Energy17.56kJ mol-1
Surface Area96.84Å2
Charge of Molecule0
Dipole3.15Debye