1,2-dimethylbenzene

Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational417.32kJ mol-1
Total (Trans. + Rot. + Vib.)427.23kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational89.01J mol-1 K-1
Total (Trans. + Rot. + Vib.)122.27J mol-1 K-1
Entropy
PropertyValueUnit
Translational166.92J mol-1 K-1
Rotational117.01J mol-1 K-1
Vibrational59.21J mol-1 K-1
Total (Trans. + Rot. + Vib.)343.14J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation25.99kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 20.30 cm-1 View
  • 2 137.79 cm-1 View
  • 3 144.98 cm-1 View
  • 4 240.79 cm-1 View
  • 5 347.23 cm-1 View
  • 6 418.36 cm-1 View
  • 7 421.29 cm-1 View
  • 8 474.09 cm-1 View
  • 9 516.82 cm-1 View
  • 10 595.88 cm-1 View
  • 11 688.52 cm-1 View
  • 12 770.45 cm-1 View
  • 13 856.78 cm-1 View
  • 14 867.25 cm-1 View
  • 15 874.40 cm-1 View
  • 16 941.94 cm-1 View
  • 17 990.85 cm-1 View
  • 18 995.34 cm-1 View
  • 19 1004.66 cm-1 View
  • 20 1007.09 cm-1 View
  • 21 1039.92 cm-1 View
  • 22 1106.70 cm-1 View
  • 23 1120.57 cm-1 View
  • 24 1154.74 cm-1 View
  • 25 1210.13 cm-1 View
  • 26 1262.49 cm-1 View
  • 27 1316.65 cm-1 View
  • 28 1344.59 cm-1 View
  • 29 1386.29 cm-1 View
  • 30 1396.18 cm-1 View
  • 31 1398.65 cm-1 View
  • 32 1403.40 cm-1 View
  • 33 1421.17 cm-1 View
  • 34 1432.08 cm-1 View
  • 35 1566.81 cm-1 View
  • 36 1634.90 cm-1 View
  • 37 1785.19 cm-1 View
  • 38 1802.30 cm-1 View
  • 39 3047.96 cm-1 View
  • 40 3052.83 cm-1 View
  • 41 3064.52 cm-1 View
  • 42 3067.28 cm-1 View
  • 43 3068.81 cm-1 View
  • 44 3070.10 cm-1 View
  • 45 3075.52 cm-1 View
  • 46 3078.71 cm-1 View
  • 47 3166.52 cm-1 View
  • 48 3172.92 cm-1 View

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy7.83kJ mol-1
Polar Solvation Energy-5.92kJ mol-1
Nonpolar Solvation Energy13.79kJ mol-1
Surface Area107.93Å2
Charge of Molecule0
Dipole0.53Debye