4.7 Article

Agostic deformations based on electron delocalization in the alkyllithium-complex [{2-(Me3Si)(2)CLiC5H4N}(2)

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CHEMICAL COMMUNICATIONS
卷 -, 期 20, 页码 2072-2073

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ROYAL SOC CHEMISTRY
DOI: 10.1039/b105452j

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Topological analysis of experimental and theoretical charge densities in the title complex[{2-(Me3Si)(2)CLiC5H4N}(2)] 1 reveals the nature of the agostic deformation postulated for this complex: delocalization of the Li-C bonding electrons over the entire agostic alkyl group controls the formation of an acute Li-C-Si angle and thus a sufficient electronic saturation of the electron deficient lithium atom via secondary interactions.

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