Molecular structure and spectroscopic properties of the 1:1 complex of quinuclidine betaine with l-tartaric acid

Journal of Molecular Structure

Volumn 936, Issue 1-3, 2009, Pages 9-14

  Dega Szafran, Z ^a   Katrusiak, A ^a   Szafran, M ^a  

^a ADAM MICKIEWICZ UNIVERSITY   (Poland)

Author keywords

DFT calculations; Hydrogen bonds; l(+) tartaric acid; Quinuclidine betaine; Spectroscopic methods; X ray diffraction

Indexed keywords

AQUEOUS SOLUTIONS; B3LYP/6-31G; BROAD BANDS; CARBOXYMETHYL; DFT CALCULATION; DFT CALCULATIONS; FT-IR SPECTRUM; FTIR; INFINITE CHAINS; L(+)-TARTARIC ACID; L-(+)- TARTARIC ACIDS; MONOCLINIC SPACE GROUPS; NMR SPECTROSCOPY; NMR SPECTRUM; OPTIMIZED STRUCTURES; PROTONATED; QUINUCLIDINE BETAINE; QUINUCLIDINES; SPECTROSCOPIC METHODS; SPECTROSCOPIC PROPERTY;

ACIDS; BINDING SITES; COMPLEXATION; DIFFRACTION; FOURIER TRANSFORM INFRARED SPECTROSCOPY; HYDROGEN; NEGATIVE IONS; NUCLEAR MAGNETIC RESONANCE; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; PROBABILITY DENSITY FUNCTION; SULFUR COMPOUNDS; X RAY DIFFRACTION; X RAY DIFFRACTION ANALYSIS;

HYDROGEN BONDS;

EID: 70349100006     PISSN: 00222860     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.molstruc.2009.07.009     Document Type: Article

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