2-(phosphonomethylamino)acetic acid

Molecule Viewer


Thermodynamics at 298.15 K and standard pressure


Enthalpy
PropertyValueUnit
Translational6.20kJ mol-1
Rotational3.72kJ mol-1
Vibrational363.70kJ mol-1
Total (Trans. + Rot. + Vib.)373.62kJ mol-1
Heat Capacity at Constant Pressure
PropertyValueUnit
Translational20.79J mol-1 K-1
Rotational12.47J mol-1 K-1
Vibrational157.68J mol-1 K-1
Total (Trans. + Rot. + Vib.)190.93J mol-1 K-1
Entropy
PropertyValueUnit
Translational172.72J mol-1 K-1
Rotational128.95J mol-1 K-1
Vibrational181.74J mol-1 K-1
Total (Trans. + Rot. + Vib.)483.41J mol-1 K-1
Other Properties
PropertyValueUnit
Heat of Formation-1194.74kJ mol-1

Molecular Orbitals


Vibrational Frequencies


Vibration
Vectors
Balls
  • 1 27.24 cm-1 View
  • 2 34.11 cm-1 View
  • 3 59.87 cm-1 View
  • 4 66.33 cm-1 View
  • 5 120.27 cm-1 View
  • 6 146.75 cm-1 View
  • 7 186.02 cm-1 View
  • 8 212.43 cm-1 View
  • 9 241.69 cm-1 View
  • 10 252.56 cm-1 View
  • 11 298.91 cm-1 View
  • 12 325.66 cm-1 View
  • 13 362.94 cm-1 View
  • 14 378.40 cm-1 View
  • 15 429.83 cm-1 View
  • 16 456.08 cm-1 View
  • 17 534.87 cm-1 View
  • 18 648.60 cm-1 View
  • 19 690.01 cm-1 View
  • 20 749.42 cm-1 View
  • 21 791.39 cm-1 View
  • 22 813.24 cm-1 View
  • 23 868.52 cm-1 View
  • 24 951.36 cm-1 View
  • 25 963.24 cm-1 View
  • 26 975.88 cm-1 View
  • 27 984.63 cm-1 View
  • 28 1024.18 cm-1 View
  • 29 1060.56 cm-1 View
  • 30 1090.74 cm-1 View
  • 31 1117.23 cm-1 View
  • 32 1124.07 cm-1 View
  • 33 1227.58 cm-1 View
  • 34 1273.74 cm-1 View
  • 35 1308.81 cm-1 View
  • 36 1353.14 cm-1 View
  • 37 1370.96 cm-1 View
  • 38 1404.45 cm-1 View
  • 39 1442.38 cm-1 View
  • 40 1985.97 cm-1 View
  • 41 2919.47 cm-1 View
  • 42 2967.11 cm-1 View
  • 43 2988.33 cm-1 View
  • 44 3046.88 cm-1 View
  • 45 3358.34 cm-1 View
  • 46 3878.50 cm-1 View
  • 47 3954.61 cm-1 View
  • 48 3958.07 cm-1 View

Aqueous Solvation Energy at 298.15 K


Surface
Dipole
Translucent Molecule
PropertyValueUnit
Total Solvation Energy-53.34kJ mol-1
Polar Solvation Energy-73.81kJ mol-1
Nonpolar Solvation Energy20.44kJ mol-1
Surface Area140.14Å2
Charge of Molecule0
Dipole4.88Debye