3-trihydroxysilylpropan-1-amine

Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational423.51kJ mol-1
Total (Trans. + Rot. + Vib.)433.42kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational140.53J mol-1 K-1
Total (Trans. + Rot. + Vib.)173.79J mol-1 K-1
Entropy
PropertyValueUnit
Translational170.11J mol-1 K-1
Rotational122.92J mol-1 K-1
Vibrational147.77J mol-1 K-1
Total (Trans. + Rot. + Vib.)440.80J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation-1058.07kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 19.77 cm-1 View
  • 2 30.78 cm-1 View
  • 3 70.31 cm-1 View
  • 4 83.26 cm-1 View
  • 5 152.53 cm-1 View
  • 6 181.48 cm-1 View
  • 7 194.12 cm-1 View
  • 8 235.28 cm-1 View
  • 9 246.77 cm-1 View
  • 10 254.81 cm-1 View
  • 11 258.22 cm-1 View
  • 12 264.95 cm-1 View
  • 13 294.46 cm-1 View
  • 14 327.90 cm-1 View
  • 15 496.00 cm-1 View
  • 16 566.84 cm-1 View
  • 17 777.15 cm-1 View
  • 18 804.38 cm-1 View
  • 19 828.60 cm-1 View
  • 20 892.80 cm-1 View
  • 21 926.11 cm-1 View
  • 22 936.03 cm-1 View
  • 23 975.18 cm-1 View
  • 24 983.58 cm-1 View
  • 25 992.96 cm-1 View
  • 26 1023.73 cm-1 View
  • 27 1035.26 cm-1 View
  • 28 1068.31 cm-1 View
  • 29 1101.32 cm-1 View
  • 30 1134.74 cm-1 View
  • 31 1143.62 cm-1 View
  • 32 1165.22 cm-1 View
  • 33 1189.06 cm-1 View
  • 34 1212.80 cm-1 View
  • 35 1279.00 cm-1 View
  • 36 1369.30 cm-1 View
  • 37 1378.16 cm-1 View
  • 38 1402.81 cm-1 View
  • 39 1413.01 cm-1 View
  • 40 1675.45 cm-1 View
  • 41 2922.48 cm-1 View
  • 42 2935.86 cm-1 View
  • 43 2998.99 cm-1 View
  • 44 3003.39 cm-1 View
  • 45 3014.65 cm-1 View
  • 46 3076.79 cm-1 View
  • 47 3376.50 cm-1 View
  • 48 3513.92 cm-1 View
  • 49 3922.17 cm-1 View
  • 50 3936.08 cm-1 View
  • 51 3946.73 cm-1 View

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy2.25kJ mol-1
Polar Solvation Energy-29.43kJ mol-1
Nonpolar Solvation Energy31.68kJ mol-1
Surface Area117.77Å2
Charge of Molecule0
Dipole2.16Debye