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The electronic structure of a series of organic molecules of general formula <*>RN-(CH2)2-X-C=Y, which are also of interest in inorganic chemistry because of their properties as ligands towards metals, have been investigated by X-ray photoelectron spectroscopy.The results suggest a general picture of atomic charge distribution within the investigated molecules, and allow an assessment of the effect of the different substituent groups X, Y, R (X=NR’, O, S, CH2; Y=O, S, Se; R, R’=H, alkyl) on the electronic structure of the ligands.Satisfactory correlation is foundbetween experimental binding energies and computed CNDO/2 atomic charges, after correction for intramolecular Madelung potentials.
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Reference：
Quinuclidine – Wikipedia,
Quinuclidine | C7H225N | ChemSpider