Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational388.18kJ mol-1
Total (Trans. + Rot. + Vib.)398.10kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational104.21J mol-1 K-1
Total (Trans. + Rot. + Vib.)137.47J mol-1 K-1
Entropy
PropertyValueUnit
Translational169.65J mol-1 K-1
Rotational121.20J mol-1 K-1
Vibrational71.19J mol-1 K-1
Total (Trans. + Rot. + Vib.)362.04J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation318.16kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 93.54 cm-1 View
  • 2 130.75 cm-1 View
  • 3 209.10 cm-1 View
  • 4 320.76 cm-1 View
  • 5 375.72 cm-1 View
  • 6 446.36 cm-1 View
  • 7 467.68 cm-1 View
  • 8 490.61 cm-1 View
  • 9 514.25 cm-1 View
  • 10 614.42 cm-1 View
  • 11 619.82 cm-1 View
  • 12 746.66 cm-1 View
  • 13 763.22 cm-1 View
  • 14 786.48 cm-1 View
  • 15 829.99 cm-1 View
  • 16 834.35 cm-1 View
  • 17 864.67 cm-1 View
  • 18 894.08 cm-1 View
  • 19 949.19 cm-1 View
  • 20 968.40 cm-1 View
  • 21 992.91 cm-1 View
  • 22 1028.67 cm-1 View
  • 23 1052.12 cm-1 View
  • 24 1061.54 cm-1 View
  • 25 1087.02 cm-1 View
  • 26 1108.38 cm-1 View
  • 27 1131.95 cm-1 View
  • 28 1150.51 cm-1 View
  • 29 1181.66 cm-1 View
  • 30 1191.54 cm-1 View
  • 31 1247.35 cm-1 View
  • 32 1351.20 cm-1 View
  • 33 1375.30 cm-1 View
  • 34 1406.42 cm-1 View
  • 35 1434.13 cm-1 View
  • 36 1509.28 cm-1 View
  • 37 1732.81 cm-1 View
  • 38 1807.82 cm-1 View
  • 39 1834.21 cm-1 View
  • 40 1857.94 cm-1 View
  • 41 2927.78 cm-1 View
  • 42 3011.66 cm-1 View
  • 43 3020.44 cm-1 View
  • 44 3040.10 cm-1 View
  • 45 3055.87 cm-1 View
  • 46 3071.32 cm-1 View
  • 47 3080.42 cm-1 View
  • 48 3083.63 cm-1 View