Intramolecular hydrogen bonding, Gauche interactions, and thermodynamic functions of 1,2-ethanediamine, 1,2-ethanediol, and 2-aminoethanol: A global conformational analysis

Keyphrases

• Dipole 100%
• Conformational Analysis 100%
• Through-space 100%
• Molecular Fragments 100%
• Intramolecular Hydrogen Bonding 100%
• Thermodynamic Functions 100%
• 1,2-ethanedithiol 100%
• 2-aminoethanol 100%
• 1,2-Ethanediamine 100%
• Direct Bond 100%
• Gauche Interaction 100%
• Interaction Function 100%
• Electrostatic Potential 50%
• Gas Phase 50%
• Decomposition Scheme 50%
• Dihedral Angle 50%
• Functional Form 50%
• Electrostatic Interaction 50%
• Functional Groups 50%
• Dipole Moment 50%
• Rotation Angle 50%
• Interaction Strength 50%
• Quadrupole Interaction 50%
• Electric Dipole 50%
• Carbon-carbon Bond 50%
• Quadrupole 50%
• Internal Rotation 50%
• Quadrupole Moment 50%
• Fourier 50%
• Energy Decomposition 50%
• Experimental Temperature 50%
• Geminal 50%
• Group Electronegativity 50%
• Vicinal 50%
• Hirshfeld Charge 50%
• Interaction Terms 50%
• Thermodynamic Data 50%
• Molecular Mechanics Method 50%
• Charge Population 50%
• Intramolecular H-bonding 50%
• Population Analysis 50%

Chemistry

• Hydrogen Bonding 100%
• Ethanediol 100%
• Quadrupole 100%
• Ethanolamine 100%
• Dihedral Angle 50%
• Electrostatic Interaction 50%
• Dipole Moment 50%
• Conformational Isomer 50%
• Møller-Plesset Perturbation Theory 50%
• Quadrupole Interaction 50%
• Conformational Potential 50%
• Molecular Mechanic 50%
• Electrostatic Potential 50%
• Internal Rotation 50%
• Electronegativity 50%
• Quadrupole Moment 50%