Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational174.40kJ mol-1
Total (Trans. + Rot. + Vib.)184.31kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational27.59J mol-1 K-1
Total (Trans. + Rot. + Vib.)60.85J mol-1 K-1
Entropy
PropertyValueUnit
Translational155.07J mol-1 K-1
Rotational90.83J mol-1 K-1
Vibrational12.84J mol-1 K-1
Total (Trans. + Rot. + Vib.)258.74J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation972.67kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 433.33 cm-1 View
  • 2 435.82 cm-1 View
  • 3 444.06 cm-1 View
  • 4 914.58 cm-1 View
  • 5 938.21 cm-1 View
  • 6 1003.25 cm-1 View
  • 7 1123.63 cm-1 View
  • 8 1168.03 cm-1 View
  • 9 1182.40 cm-1 View
  • 10 1264.14 cm-1 View
  • 11 1302.47 cm-1 View
  • 12 1511.44 cm-1 View
  • 13 1705.48 cm-1 View
  • 14 2975.24 cm-1 View
  • 15 3058.74 cm-1 View
  • 16 3059.69 cm-1 View
  • 17 3086.84 cm-1 View
  • 18 3089.51 cm-1 View