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Structural features of tricarbonyl(N-methyl-2-pyridinecarboxyamide)chloro-rhenium(I)-potential precursor of radiopharmaceuticals
Authors:L Fuks  E Gniazdowska  J Mieczkowski  N Sadlej-Sosnowska
Institution:1. Institute of Nuclear Chemistry and Technology, Dorodna 16, 03-195 Warsaw, Poland;2. Department of Chemistry, Warsaw University, Pasteura 1, 02-093 Warsaw, Poland;3. National Drug Institute, Chelmska 30/34, 00-725 Warsaw, Poland
Abstract:Structural characteristics of the novel fac-Re(CO)3L]Cl complex, where L denotes the N-methyl-2-pyridinecarboxyamide, are presented. Molecular structure of the complex has been established by means of X-ray single crystal diffraction and compared with quantum mechanical calculations. It has been shown that pyridinethioamide is softer base than pyridineamide. As a result of different ReI–S and ReI–O bond covalent shortenings (reflecting their diverse ionic/covalent character ratio) difference of the bond lengths decreases from a theoretical value of 0.45 Å to the value of 0.28 Å.
Keywords:Tricarbonylrhenium(I)  N-Methyl-2-pyridinecarboxyamide  Structural studies  DFT calculations  Covalent bond  Ionic bond
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