N,n-dihydroxyaniline

Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational280.83kJ mol-1
Total (Trans. + Rot. + Vib.)290.74kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational83.49J mol-1 K-1
Total (Trans. + Rot. + Vib.)116.74J mol-1 K-1
Entropy
PropertyValueUnit
Translational168.76J mol-1 K-1
Rotational119.66J mol-1 K-1
Vibrational67.89J mol-1 K-1
Total (Trans. + Rot. + Vib.)356.31J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation61.51kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 34.93 cm-1 View
  • 2 153.74 cm-1 View
  • 3 245.38 cm-1 View
  • 4 350.83 cm-1 View
  • 5 407.42 cm-1 View
  • 6 418.36 cm-1 View
  • 7 521.56 cm-1 View
  • 8 607.77 cm-1 View
  • 9 629.15 cm-1 View
  • 10 670.86 cm-1 View
  • 11 728.46 cm-1 View
  • 12 814.37 cm-1 View
  • 13 837.12 cm-1 View
  • 14 853.39 cm-1 View
  • 15 963.70 cm-1 View
  • 16 988.34 cm-1 View
  • 17 1031.04 cm-1 View
  • 18 1031.15 cm-1 View
  • 19 1106.88 cm-1 View
  • 20 1113.43 cm-1 View
  • 21 1156.01 cm-1 View
  • 22 1180.90 cm-1 View
  • 23 1238.86 cm-1 View
  • 24 1296.61 cm-1 View
  • 25 1327.22 cm-1 View
  • 26 1545.46 cm-1 View
  • 27 1559.82 cm-1 View
  • 28 1605.12 cm-1 View
  • 29 1772.96 cm-1 View
  • 30 1786.43 cm-1 View
  • 31 1893.10 cm-1 View
  • 32 3029.16 cm-1 View
  • 33 3031.85 cm-1 View
  • 34 3051.44 cm-1 View
  • 35 3061.50 cm-1 View
  • 36 3072.68 cm-1 View

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy-24.68kJ mol-1
Polar Solvation Energy-33.20kJ mol-1
Nonpolar Solvation Energy8.57kJ mol-1
Surface Area121.48Å2
Charge of Molecule0
Dipole6.23Debye