1-(2-hydroxyethyl)pyrrolidin-2-one

Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational458.32kJ mol-1
Total (Trans. + Rot. + Vib.)468.24kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational114.19J mol-1 K-1
Total (Trans. + Rot. + Vib.)147.45J mol-1 K-1
Entropy
PropertyValueUnit
Translational169.36J mol-1 K-1
Rotational121.01J mol-1 K-1
Vibrational97.13J mol-1 K-1
Total (Trans. + Rot. + Vib.)387.50J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation-408.93kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 53.26 cm-1 View
  • 2 97.56 cm-1 View
  • 3 101.94 cm-1 View
  • 4 175.14 cm-1 View
  • 5 274.40 cm-1 View
  • 6 293.86 cm-1 View
  • 7 381.34 cm-1 View
  • 8 473.26 cm-1 View
  • 9 504.72 cm-1 View
  • 10 549.11 cm-1 View
  • 11 575.01 cm-1 View
  • 12 588.67 cm-1 View
  • 13 648.38 cm-1 View
  • 14 781.90 cm-1 View
  • 15 831.35 cm-1 View
  • 16 888.73 cm-1 View
  • 17 894.64 cm-1 View
  • 18 937.89 cm-1 View
  • 19 994.38 cm-1 View
  • 20 1002.72 cm-1 View
  • 21 1023.98 cm-1 View
  • 22 1049.74 cm-1 View
  • 23 1057.80 cm-1 View
  • 24 1077.88 cm-1 View
  • 25 1094.55 cm-1 View
  • 26 1105.88 cm-1 View
  • 27 1115.19 cm-1 View
  • 28 1125.09 cm-1 View
  • 29 1141.74 cm-1 View
  • 30 1156.81 cm-1 View
  • 31 1262.90 cm-1 View
  • 32 1287.68 cm-1 View
  • 33 1306.87 cm-1 View
  • 34 1317.33 cm-1 View
  • 35 1334.96 cm-1 View
  • 36 1373.49 cm-1 View
  • 37 1382.20 cm-1 View
  • 38 1386.09 cm-1 View
  • 39 1391.22 cm-1 View
  • 40 1401.57 cm-1 View
  • 41 1422.93 cm-1 View
  • 42 1465.51 cm-1 View
  • 43 1931.79 cm-1 View
  • 44 2927.31 cm-1 View
  • 45 2939.24 cm-1 View
  • 46 2943.82 cm-1 View
  • 47 2975.44 cm-1 View
  • 48 2989.26 cm-1 View
  • 49 3005.58 cm-1 View
  • 50 3013.04 cm-1 View
  • 51 3026.44 cm-1 View
  • 52 3061.52 cm-1 View
  • 53 3067.55 cm-1 View
  • 54 3784.47 cm-1 View

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy-7.88kJ mol-1
Polar Solvation Energy-25.92kJ mol-1
Nonpolar Solvation Energy18.06kJ mol-1
Surface Area115.11Å2
Charge of Molecule0
Dipole5.79Debye