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Conformational analysis of mono-and bis(dimethoxyphosphoryl)benzenes
Authors
Chachkov D.
Dogadina A.
+5 more
Gazizova A.
Ishmaeva E.
Katsyuba S.
Tverdomed S.
Vereshchagina Y.
Publication date
1 January 2006
Publisher
Abstract
Conformational analysis of mono-and bis(dimethoxyphosphoryl)benzenes with substituents in the benzene ring was performed by the method of dipole moments, IR spectroscopy, and quantum-chemical calculations (DFT B3LYP/6-31G*). Comparison of all calculated and experimental data shows that the compounds studied exist as equilibrium mixtures of conformers with preferred gg orientation of the phosphoryl and methoxy groups. © Pleiades Publishing, Inc., 2006
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Last time updated on 07/05/2019