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Neutron Diffraction Characterization of C–H···Li Interactions in a Lithium Aluminate Polymer

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https://figshare.com/articles/dataset/Neutron_Diffraction_Characterization_of_C_H_Li_Interactions_in_a_Lithium_Aluminate_Polymer/2266831
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The reaction of AlMe3 with tBuLi in the presence of trimethylacetonitrile affords the bimetallic complex [tBu­(Me)­Al­(μ-Me)2Li·NC­(tBu)]∞ (1). Pseudotetrahedral Al centers form by the nucelophilic addition of tBuLi to AlMe3.The alkali-metal center is stabilized through coordination of the unreacted nitrile and polymer formation via the construction of Al­(μ-Me)nLi (n = 1, 2) motifs. Neutron diffraction evidences agostic interactions in the bridging methyl group to give further stabilization. There is only one previous report of a neutron structure of a lithium aluminate compound. This work therefore offers an important structural example of agostic interactions and the precise nature of Al­(μ-Me)2Li bridging.
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2016-02-17
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