Pentan-1-ol

Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational440.78kJ mol-1
Total (Trans. + Rot. + Vib.)450.70kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational94.07J mol-1 K-1
Total (Trans. + Rot. + Vib.)127.32J mol-1 K-1
Entropy
PropertyValueUnit
Translational164.60J mol-1 K-1
Rotational113.62J mol-1 K-1
Vibrational93.88J mol-1 K-1
Total (Trans. + Rot. + Vib.)372.10J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation-305.09kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 62.10 cm-1 View
  • 2 93.20 cm-1 View
  • 3 115.56 cm-1 View
  • 4 165.00 cm-1 View
  • 5 188.68 cm-1 View
  • 6 197.74 cm-1 View
  • 7 344.74 cm-1 View
  • 8 400.02 cm-1 View
  • 9 520.02 cm-1 View
  • 10 761.71 cm-1 View
  • 11 805.96 cm-1 View
  • 12 888.47 cm-1 View
  • 13 958.22 cm-1 View
  • 14 969.33 cm-1 View
  • 15 1040.79 cm-1 View
  • 16 1071.04 cm-1 View
  • 17 1098.80 cm-1 View
  • 18 1121.29 cm-1 View
  • 19 1128.69 cm-1 View
  • 20 1130.80 cm-1 View
  • 21 1143.77 cm-1 View
  • 22 1156.72 cm-1 View
  • 23 1156.81 cm-1 View
  • 24 1164.33 cm-1 View
  • 25 1215.56 cm-1 View
  • 26 1277.98 cm-1 View
  • 27 1322.98 cm-1 View
  • 28 1375.13 cm-1 View
  • 29 1380.07 cm-1 View
  • 30 1388.32 cm-1 View
  • 31 1409.07 cm-1 View
  • 32 1411.25 cm-1 View
  • 33 1413.26 cm-1 View
  • 34 1417.93 cm-1 View
  • 35 1428.78 cm-1 View
  • 36 1438.32 cm-1 View
  • 37 2908.03 cm-1 View
  • 38 2941.63 cm-1 View
  • 39 2956.13 cm-1 View
  • 40 2962.20 cm-1 View
  • 41 2968.72 cm-1 View
  • 42 3027.87 cm-1 View
  • 43 3034.37 cm-1 View
  • 44 3039.71 cm-1 View
  • 45 3078.43 cm-1 View
  • 46 3084.88 cm-1 View
  • 47 3181.68 cm-1 View
  • 48 3909.39 cm-1 View

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy10.06kJ mol-1
Polar Solvation Energy-11.21kJ mol-1
Nonpolar Solvation Energy21.32kJ mol-1
Surface Area98.77Å2
Charge of Molecule0
Dipole1.68Debye