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Hybridization of Nitrogen Determines Hydrogen-Bond Acceptor Strength: Gas-Phase Comparison of Redshifts and Equilibrium Constants
Kristian Holten Møller
,
Alexander Kjærsgaard
, Anne Schou Reinholdt, Lin Du,
Henrik Grum Kjærgaard
Kemisk Institut
6
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Keyphrases
Acceptor Strength
100%
Hydrogen Donor
100%
Gas Phase
100%
Equilibrium Constant
100%
Lone Pair
66%
Observed Trends
33%
Fourier Transform Infrared Spectroscopy (FT-IR)
33%
Trimethylamine
33%
Hybridization Effect
33%
Sp2-hybridized
33%
Nitrogen Atom
33%
Acetonitrile
33%
Quantum Chemical Calculations
33%
Bonding Structure
33%
2,2,2-Trifluoroethanol
33%
Hydrogen Bonds (H-bonds)
33%
Ethanol
33%
Pyridine
33%
Methanol
33%
Bimolecular Complex
33%
Chemistry
Equilibrium Constant
100%
Hydrogen Bonding
100%
Fourier Transform Infrared Spectroscopy
25%
Methanol
25%
Alkalinity
25%
Nitrogen Atom
25%
Acetonitrile
25%
Quantum Chemical Calculations
25%
Trimethylamine
25%
Chemical Engineering
Methanol
100%
Acetonitrile
100%