Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational629.01kJ mol-1
Total (Trans. + Rot. + Vib.)638.92kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational148.13J mol-1 K-1
Total (Trans. + Rot. + Vib.)181.39J mol-1 K-1
Entropy
PropertyValueUnit
Translational170.39J mol-1 K-1
Rotational125.83J mol-1 K-1
Vibrational134.51J mol-1 K-1
Total (Trans. + Rot. + Vib.)430.72J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation-225.77kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 42.65 cm-1 View
  • 2 75.06 cm-1 View
  • 3 102.97 cm-1 View
  • 4 148.08 cm-1 View
  • 5 169.22 cm-1 View
  • 6 184.59 cm-1 View
  • 7 239.40 cm-1 View
  • 8 260.34 cm-1 View
  • 9 310.92 cm-1 View
  • 10 336.22 cm-1 View
  • 11 432.66 cm-1 View
  • 12 456.09 cm-1 View
  • 13 503.15 cm-1 View
  • 14 515.51 cm-1 View
  • 15 539.88 cm-1 View
  • 16 699.19 cm-1 View
  • 17 782.80 cm-1 View
  • 18 841.95 cm-1 View
  • 19 888.38 cm-1 View
  • 20 902.05 cm-1 View
  • 21 920.31 cm-1 View
  • 22 932.07 cm-1 View
  • 23 960.58 cm-1 View
  • 24 982.77 cm-1 View
  • 25 999.10 cm-1 View
  • 26 1025.81 cm-1 View
  • 27 1042.53 cm-1 View
  • 28 1057.62 cm-1 View
  • 29 1083.26 cm-1 View
  • 30 1101.15 cm-1 View
  • 31 1119.34 cm-1 View
  • 32 1123.14 cm-1 View
  • 33 1132.81 cm-1 View
  • 34 1134.85 cm-1 View
  • 35 1150.55 cm-1 View
  • 36 1157.06 cm-1 View
  • 37 1178.13 cm-1 View
  • 38 1225.57 cm-1 View
  • 39 1239.69 cm-1 View
  • 40 1290.65 cm-1 View
  • 41 1303.81 cm-1 View
  • 42 1335.04 cm-1 View
  • 43 1359.84 cm-1 View
  • 44 1367.65 cm-1 View
  • 45 1383.01 cm-1 View
  • 46 1391.96 cm-1 View
  • 47 1402.25 cm-1 View
  • 48 1406.06 cm-1 View
  • 49 1407.78 cm-1 View
  • 50 1408.54 cm-1 View
  • 51 1410.96 cm-1 View
  • 52 1412.70 cm-1 View
  • 53 1417.48 cm-1 View
  • 54 1428.34 cm-1 View
  • 55 1450.81 cm-1 View
  • 56 1877.09 cm-1 View
  • 57 2845.20 cm-1 View
  • 58 2931.74 cm-1 View
  • 59 2945.13 cm-1 View
  • 60 2960.81 cm-1 View
  • 61 2970.99 cm-1 View
  • 62 3011.34 cm-1 View
  • 63 3023.97 cm-1 View
  • 64 3040.16 cm-1 View
  • 65 3040.84 cm-1 View
  • 66 3047.13 cm-1 View
  • 67 3081.27 cm-1 View
  • 68 3084.78 cm-1 View
  • 69 3085.33 cm-1 View
  • 70 3088.70 cm-1 View
  • 71 3182.17 cm-1 View
  • 72 3182.68 cm-1 View