Propane

Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational273.28kJ mol-1
Total (Trans. + Rot. + Vib.)283.19kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational37.38J mol-1 K-1
Total (Trans. + Rot. + Vib.)70.64J mol-1 K-1
Entropy
PropertyValueUnit
Translational155.96J mol-1 K-1
Rotational94.72J mol-1 K-1
Vibrational26.07J mol-1 K-1
Total (Trans. + Rot. + Vib.)276.75J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation-98.74kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 176.53 cm-1 View
  • 2 210.46 cm-1 View
  • 3 410.93 cm-1 View
  • 4 802.72 cm-1 View
  • 5 935.96 cm-1 View
  • 6 955.96 cm-1 View
  • 7 967.21 cm-1 View
  • 8 1127.99 cm-1 View
  • 9 1133.02 cm-1 View
  • 10 1135.55 cm-1 View
  • 11 1157.14 cm-1 View
  • 12 1316.27 cm-1 View
  • 13 1382.91 cm-1 View
  • 14 1405.51 cm-1 View
  • 15 1410.31 cm-1 View
  • 16 1411.28 cm-1 View
  • 17 1412.91 cm-1 View
  • 18 1427.29 cm-1 View
  • 19 1430.25 cm-1 View
  • 20 2956.85 cm-1 View
  • 21 3038.54 cm-1 View
  • 22 3078.78 cm-1 View
  • 23 3079.64 cm-1 View
  • 24 3084.53 cm-1 View
  • 25 3086.44 cm-1 View
  • 26 3181.47 cm-1 View
  • 27 3182.80 cm-1 View

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy12.51kJ mol-1
Polar Solvation Energy-0.46kJ mol-1
Nonpolar Solvation Energy12.96kJ mol-1
Surface Area71.12Å2
Charge of Molecule0
Dipole0.01Debye