1,4-dioxane

Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational316.25kJ mol-1
Total (Trans. + Rot. + Vib.)326.17kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational60.50J mol-1 K-1
Total (Trans. + Rot. + Vib.)93.76J mol-1 K-1
Entropy
PropertyValueUnit
Translational164.59J mol-1 K-1
Rotational108.97J mol-1 K-1
Vibrational34.20J mol-1 K-1
Total (Trans. + Rot. + Vib.)307.76J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation-347.46kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 188.97 cm-1 View
  • 2 251.16 cm-1 View
  • 3 341.08 cm-1 View
  • 4 504.83 cm-1 View
  • 5 512.74 cm-1 View
  • 6 668.24 cm-1 View
  • 7 837.61 cm-1 View
  • 8 931.75 cm-1 View
  • 9 965.76 cm-1 View
  • 10 981.34 cm-1 View
  • 11 988.35 cm-1 View
  • 12 1021.21 cm-1 View
  • 13 1035.42 cm-1 View
  • 14 1042.23 cm-1 View
  • 15 1073.84 cm-1 View
  • 16 1091.79 cm-1 View
  • 17 1116.53 cm-1 View
  • 18 1121.08 cm-1 View
  • 19 1131.86 cm-1 View
  • 20 1153.15 cm-1 View
  • 21 1304.83 cm-1 View
  • 22 1307.39 cm-1 View
  • 23 1333.73 cm-1 View
  • 24 1360.39 cm-1 View
  • 25 1365.99 cm-1 View
  • 26 1370.94 cm-1 View
  • 27 1377.64 cm-1 View
  • 28 1380.14 cm-1 View
  • 29 2948.59 cm-1 View
  • 30 2950.37 cm-1 View
  • 31 2961.54 cm-1 View
  • 32 2962.61 cm-1 View
  • 33 3040.94 cm-1 View
  • 34 3042.32 cm-1 View
  • 35 3043.93 cm-1 View
  • 36 3045.64 cm-1 View