Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational457.19kJ mol-1
Total (Trans. + Rot. + Vib.)467.11kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational139.48J mol-1 K-1
Total (Trans. + Rot. + Vib.)172.74J mol-1 K-1
Entropy
PropertyValueUnit
Translational169.37J mol-1 K-1
Rotational122.85J mol-1 K-1
Vibrational146.87J mol-1 K-1
Total (Trans. + Rot. + Vib.)439.08J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation144.06kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 35.62 cm-1 View
  • 2 37.85 cm-1 View
  • 3 72.37 cm-1 View
  • 4 152.71 cm-1 View
  • 5 162.92 cm-1 View
  • 6 178.18 cm-1 View
  • 7 190.70 cm-1 View
  • 8 256.55 cm-1 View
  • 9 275.17 cm-1 View
  • 10 324.61 cm-1 View
  • 11 377.56 cm-1 View
  • 12 438.85 cm-1 View
  • 13 525.43 cm-1 View
  • 14 536.41 cm-1 View
  • 15 586.78 cm-1 View
  • 16 637.48 cm-1 View
  • 17 677.60 cm-1 View
  • 18 768.25 cm-1 View
  • 19 833.12 cm-1 View
  • 20 883.96 cm-1 View
  • 21 940.53 cm-1 View
  • 22 945.19 cm-1 View
  • 23 952.94 cm-1 View
  • 24 967.28 cm-1 View
  • 25 978.87 cm-1 View
  • 26 1084.09 cm-1 View
  • 27 1087.27 cm-1 View
  • 28 1111.48 cm-1 View
  • 29 1132.89 cm-1 View
  • 30 1163.93 cm-1 View
  • 31 1186.98 cm-1 View
  • 32 1276.55 cm-1 View
  • 33 1355.93 cm-1 View
  • 34 1371.33 cm-1 View
  • 35 1375.84 cm-1 View
  • 36 1377.06 cm-1 View
  • 37 1379.21 cm-1 View
  • 38 1384.24 cm-1 View
  • 39 1391.53 cm-1 View
  • 40 1483.05 cm-1 View
  • 41 1671.98 cm-1 View
  • 42 1764.50 cm-1 View
  • 43 1826.03 cm-1 View
  • 44 3036.31 cm-1 View
  • 45 3042.15 cm-1 View
  • 46 3060.68 cm-1 View
  • 47 3064.21 cm-1 View
  • 48 3135.15 cm-1 View
  • 49 3136.33 cm-1 View
  • 50 3332.71 cm-1 View
  • 51 3400.19 cm-1 View
  • 52 3431.30 cm-1 View
  • 53 3449.17 cm-1 View
  • 54 3521.01 cm-1 View