N,n-dihydroxyaniline

Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational280.88kJ mol-1
Total (Trans. + Rot. + Vib.)290.80kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational83.43J mol-1 K-1
Total (Trans. + Rot. + Vib.)116.69J mol-1 K-1
Entropy
PropertyValueUnit
Translational168.76J mol-1 K-1
Rotational119.66J mol-1 K-1
Vibrational68.98J mol-1 K-1
Total (Trans. + Rot. + Vib.)357.40J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation60.78kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 30.18 cm-1 View
  • 2 154.36 cm-1 View
  • 3 247.07 cm-1 View
  • 4 352.60 cm-1 View
  • 5 407.68 cm-1 View
  • 6 417.36 cm-1 View
  • 7 521.92 cm-1 View
  • 8 608.12 cm-1 View
  • 9 629.36 cm-1 View
  • 10 670.74 cm-1 View
  • 11 728.83 cm-1 View
  • 12 814.41 cm-1 View
  • 13 837.27 cm-1 View
  • 14 854.33 cm-1 View
  • 15 963.84 cm-1 View
  • 16 988.95 cm-1 View
  • 17 1031.31 cm-1 View
  • 18 1031.57 cm-1 View
  • 19 1108.36 cm-1 View
  • 20 1113.85 cm-1 View
  • 21 1156.63 cm-1 View
  • 22 1181.81 cm-1 View
  • 23 1239.90 cm-1 View
  • 24 1297.10 cm-1 View
  • 25 1327.28 cm-1 View
  • 26 1545.76 cm-1 View
  • 27 1559.85 cm-1 View
  • 28 1605.38 cm-1 View
  • 29 1774.06 cm-1 View
  • 30 1785.20 cm-1 View
  • 31 1893.07 cm-1 View
  • 32 3028.40 cm-1 View
  • 33 3031.02 cm-1 View
  • 34 3052.09 cm-1 View
  • 35 3061.63 cm-1 View
  • 36 3072.84 cm-1 View

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy-22.90kJ mol-1
Polar Solvation Energy-32.73kJ mol-1
Nonpolar Solvation Energy9.82kJ mol-1
Surface Area118.12Å2
Charge of Molecule0
Dipole6.24Debye