Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational658.43kJ mol-1
Total (Trans. + Rot. + Vib.)668.35kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational139.65J mol-1 K-1
Total (Trans. + Rot. + Vib.)172.90J mol-1 K-1
Entropy
PropertyValueUnit
Translational167.83J mol-1 K-1
Rotational121.27J mol-1 K-1
Vibrational115.49J mol-1 K-1
Total (Trans. + Rot. + Vib.)404.59J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation-207.78kJ mol-1

Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 82.59 cm-1 View
  • 2 111.27 cm-1 View
  • 3 152.59 cm-1 View
  • 4 196.88 cm-1 View
  • 5 202.27 cm-1 View
  • 6 224.25 cm-1 View
  • 7 234.28 cm-1 View
  • 8 266.66 cm-1 View
  • 9 322.61 cm-1 View
  • 10 348.55 cm-1 View
  • 11 379.13 cm-1 View
  • 12 425.48 cm-1 View
  • 13 457.16 cm-1 View
  • 14 549.20 cm-1 View
  • 15 594.77 cm-1 View
  • 16 790.88 cm-1 View
  • 17 845.05 cm-1 View
  • 18 922.39 cm-1 View
  • 19 943.46 cm-1 View
  • 20 967.29 cm-1 View
  • 21 976.07 cm-1 View
  • 22 993.85 cm-1 View
  • 23 1002.97 cm-1 View
  • 24 1022.65 cm-1 View
  • 25 1063.80 cm-1 View
  • 26 1072.46 cm-1 View
  • 27 1116.70 cm-1 View
  • 28 1118.66 cm-1 View
  • 29 1139.54 cm-1 View
  • 30 1147.89 cm-1 View
  • 31 1157.19 cm-1 View
  • 32 1164.07 cm-1 View
  • 33 1168.17 cm-1 View
  • 34 1208.14 cm-1 View
  • 35 1235.58 cm-1 View
  • 36 1276.67 cm-1 View
  • 37 1312.12 cm-1 View
  • 38 1316.94 cm-1 View
  • 39 1346.79 cm-1 View
  • 40 1376.63 cm-1 View
  • 41 1394.34 cm-1 View
  • 42 1396.42 cm-1 View
  • 43 1400.76 cm-1 View
  • 44 1406.24 cm-1 View
  • 45 1407.22 cm-1 View
  • 46 1408.04 cm-1 View
  • 47 1410.26 cm-1 View
  • 48 1411.72 cm-1 View
  • 49 1414.06 cm-1 View
  • 50 1416.70 cm-1 View
  • 51 1422.74 cm-1 View
  • 52 1425.47 cm-1 View
  • 53 1434.33 cm-1 View
  • 54 1441.42 cm-1 View
  • 55 2810.43 cm-1 View
  • 56 2862.44 cm-1 View
  • 57 2911.71 cm-1 View
  • 58 2922.10 cm-1 View
  • 59 3015.18 cm-1 View
  • 60 3015.82 cm-1 View
  • 61 3027.79 cm-1 View
  • 62 3044.80 cm-1 View
  • 63 3051.88 cm-1 View
  • 64 3077.98 cm-1 View
  • 65 3080.79 cm-1 View
  • 66 3081.56 cm-1 View
  • 67 3084.48 cm-1 View
  • 68 3087.77 cm-1 View
  • 69 3162.08 cm-1 View
  • 70 3164.11 cm-1 View
  • 71 3167.45 cm-1 View
  • 72 3180.96 cm-1 View

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy26.20kJ mol-1
Polar Solvation Energy-0.86kJ mol-1
Nonpolar Solvation Energy27.04kJ mol-1
Surface Area121.98Å2
Charge of Molecule0
Dipole0.05Debye