Buta-1,3-diene

Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational224.65kJ mol-1
Total (Trans. + Rot. + Vib.)234.57kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational42.49J mol-1 K-1
Total (Trans. + Rot. + Vib.)75.74J mol-1 K-1
Entropy
PropertyValueUnit
Translational158.51J mol-1 K-1
Rotational98.59J mol-1 K-1
Vibrational30.56J mol-1 K-1
Total (Trans. + Rot. + Vib.)287.66J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation129.72kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 86.24 cm-1 View
  • 2 335.70 cm-1 View
  • 3 510.73 cm-1 View
  • 4 530.87 cm-1 View
  • 5 707.72 cm-1 View
  • 6 915.60 cm-1 View
  • 7 924.60 cm-1 View
  • 8 942.54 cm-1 View
  • 9 964.30 cm-1 View
  • 10 1017.85 cm-1 View
  • 11 1041.45 cm-1 View
  • 12 1193.98 cm-1 View
  • 13 1208.20 cm-1 View
  • 14 1267.81 cm-1 View
  • 15 1321.47 cm-1 View
  • 16 1377.28 cm-1 View
  • 17 1824.83 cm-1 View
  • 18 1873.62 cm-1 View
  • 19 3033.22 cm-1 View
  • 20 3040.82 cm-1 View
  • 21 3135.56 cm-1 View
  • 22 3136.13 cm-1 View
  • 23 3147.39 cm-1 View
  • 24 3147.93 cm-1 View