N-methylaniline

Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational387.79kJ mol-1
Total (Trans. + Rot. + Vib.)397.70kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational90.42J mol-1 K-1
Total (Trans. + Rot. + Vib.)123.67J mol-1 K-1
Entropy
PropertyValueUnit
Translational167.03J mol-1 K-1
Rotational117.13J mol-1 K-1
Vibrational63.83J mol-1 K-1
Total (Trans. + Rot. + Vib.)347.99J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation86.77kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 89.38 cm-1 View
  • 2 159.19 cm-1 View
  • 3 218.13 cm-1 View
  • 4 320.85 cm-1 View
  • 5 360.48 cm-1 View
  • 6 454.06 cm-1 View
  • 7 476.17 cm-1 View
  • 8 558.42 cm-1 View
  • 9 630.16 cm-1 View
  • 10 642.44 cm-1 View
  • 11 756.46 cm-1 View
  • 12 800.75 cm-1 View
  • 13 844.02 cm-1 View
  • 14 845.45 cm-1 View
  • 15 926.14 cm-1 View
  • 16 972.58 cm-1 View
  • 17 998.96 cm-1 View
  • 18 1008.64 cm-1 View
  • 19 1032.58 cm-1 View
  • 20 1066.47 cm-1 View
  • 21 1105.27 cm-1 View
  • 22 1122.59 cm-1 View
  • 23 1152.68 cm-1 View
  • 24 1161.50 cm-1 View
  • 25 1191.24 cm-1 View
  • 26 1263.13 cm-1 View
  • 27 1293.58 cm-1 View
  • 28 1338.30 cm-1 View
  • 29 1364.87 cm-1 View
  • 30 1378.84 cm-1 View
  • 31 1407.12 cm-1 View
  • 32 1439.33 cm-1 View
  • 33 1553.45 cm-1 View
  • 34 1590.70 cm-1 View
  • 35 1775.29 cm-1 View
  • 36 1791.11 cm-1 View
  • 37 3010.08 cm-1 View
  • 38 3026.51 cm-1 View
  • 39 3050.13 cm-1 View
  • 40 3050.49 cm-1 View
  • 41 3059.94 cm-1 View
  • 42 3065.66 cm-1 View
  • 43 3080.21 cm-1 View
  • 44 3122.29 cm-1 View
  • 45 3374.41 cm-1 View

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy4.97kJ mol-1
Polar Solvation Energy-11.53kJ mol-1
Nonpolar Solvation Energy16.51kJ mol-1
Surface Area108.68Å2
Charge of Molecule0
Dipole1.43Debye