Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational543.45kJ mol-1
Total (Trans. + Rot. + Vib.)553.37kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational133.70J mol-1 K-1
Total (Trans. + Rot. + Vib.)166.96J mol-1 K-1
Entropy
PropertyValueUnit
Translational169.93J mol-1 K-1
Rotational124.31J mol-1 K-1
Vibrational118.48J mol-1 K-1
Total (Trans. + Rot. + Vib.)412.72J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation41.18kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 38.12 cm-1 View
  • 2 60.57 cm-1 View
  • 3 105.11 cm-1 View
  • 4 181.13 cm-1 View
  • 5 229.03 cm-1 View
  • 6 242.65 cm-1 View
  • 7 332.12 cm-1 View
  • 8 358.86 cm-1 View
  • 9 370.35 cm-1 View
  • 10 401.88 cm-1 View
  • 11 484.65 cm-1 View
  • 12 493.80 cm-1 View
  • 13 602.50 cm-1 View
  • 14 629.34 cm-1 View
  • 15 659.84 cm-1 View
  • 16 773.60 cm-1 View
  • 17 848.59 cm-1 View
  • 18 875.75 cm-1 View
  • 19 899.28 cm-1 View
  • 20 934.10 cm-1 View
  • 21 946.54 cm-1 View
  • 22 963.73 cm-1 View
  • 23 977.15 cm-1 View
  • 24 1006.25 cm-1 View
  • 25 1015.22 cm-1 View
  • 26 1042.93 cm-1 View
  • 27 1056.89 cm-1 View
  • 28 1063.69 cm-1 View
  • 29 1102.27 cm-1 View
  • 30 1113.96 cm-1 View
  • 31 1119.78 cm-1 View
  • 32 1131.01 cm-1 View
  • 33 1153.37 cm-1 View
  • 34 1155.96 cm-1 View
  • 35 1186.18 cm-1 View
  • 36 1222.30 cm-1 View
  • 37 1240.28 cm-1 View
  • 38 1306.09 cm-1 View
  • 39 1313.81 cm-1 View
  • 40 1317.36 cm-1 View
  • 41 1381.49 cm-1 View
  • 42 1400.02 cm-1 View
  • 43 1407.79 cm-1 View
  • 44 1412.99 cm-1 View
  • 45 1416.26 cm-1 View
  • 46 1542.16 cm-1 View
  • 47 1605.78 cm-1 View
  • 48 1670.09 cm-1 View
  • 49 1781.44 cm-1 View
  • 50 1799.43 cm-1 View
  • 51 2848.93 cm-1 View
  • 52 2941.30 cm-1 View
  • 53 3016.44 cm-1 View
  • 54 3050.27 cm-1 View
  • 55 3051.30 cm-1 View
  • 56 3060.30 cm-1 View
  • 57 3067.60 cm-1 View
  • 58 3072.48 cm-1 View
  • 59 3079.63 cm-1 View
  • 60 3084.80 cm-1 View
  • 61 3175.81 cm-1 View
  • 62 3383.27 cm-1 View
  • 63 3517.68 cm-1 View