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
Vibrational89.02J 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
Vibrational59.30J mol-1 K-1
Total (Trans. + Rot. + Vib.)343.23J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation25.99kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 19.23 cm-1 View
  • 2 136.51 cm-1 View
  • 3 144.85 cm-1 View
  • 4 240.81 cm-1 View
  • 5 347.19 cm-1 View
  • 6 418.38 cm-1 View
  • 7 421.13 cm-1 View
  • 8 474.06 cm-1 View
  • 9 516.84 cm-1 View
  • 10 595.90 cm-1 View
  • 11 688.50 cm-1 View
  • 12 770.47 cm-1 View
  • 13 856.77 cm-1 View
  • 14 867.23 cm-1 View
  • 15 874.42 cm-1 View
  • 16 941.96 cm-1 View
  • 17 990.87 cm-1 View
  • 18 995.33 cm-1 View
  • 19 1004.68 cm-1 View
  • 20 1007.04 cm-1 View
  • 21 1039.92 cm-1 View
  • 22 1106.63 cm-1 View
  • 23 1120.56 cm-1 View
  • 24 1154.73 cm-1 View
  • 25 1210.12 cm-1 View
  • 26 1262.47 cm-1 View
  • 27 1316.74 cm-1 View
  • 28 1344.62 cm-1 View
  • 29 1386.26 cm-1 View
  • 30 1396.22 cm-1 View
  • 31 1398.69 cm-1 View
  • 32 1403.33 cm-1 View
  • 33 1421.15 cm-1 View
  • 34 1432.13 cm-1 View
  • 35 1566.81 cm-1 View
  • 36 1634.86 cm-1 View
  • 37 1785.18 cm-1 View
  • 38 1802.30 cm-1 View
  • 39 3047.96 cm-1 View
  • 40 3052.87 cm-1 View
  • 41 3064.50 cm-1 View
  • 42 3067.18 cm-1 View
  • 43 3068.92 cm-1 View
  • 44 3070.24 cm-1 View
  • 45 3075.46 cm-1 View
  • 46 3078.67 cm-1 View
  • 47 3166.57 cm-1 View
  • 48 3173.03 cm-1 View

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy5.40kJ mol-1
Polar Solvation Energy-5.96kJ mol-1
Nonpolar Solvation Energy11.41kJ mol-1
Surface Area112.98Å2
Charge of Molecule0
Dipole0.53Debye