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Bonding and Reactivity of a Dicopper(I) μ‑Boryl Cation

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https://figshare.com/articles/dataset/Bonding_and_Reactivity_of_a_Dicopper_I_Boryl_Cation/2084413
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A siloxide-bridged dicopper­(I) cation reacts with bis­(catecholato)­diboron to form the boryl-bridged dicopper cation {[(SIDipp)­Cu]2(μ-Bcat)}+ (SIDipp = 1,3-bis­(2,6-diisopropylphenyl)­imidazolin-2-ylidene; cat = 1,2-C6H4O2). The solid-state structure shows an acute angle about the boryl, with a short intermetallic distance. Density functional theory calculations indicate a small but significant copper–copper bond order. The boryl-bridged cation deprotonates phenylacetylene and reacts with methanol to form a hydride-bridged dicopper cation.
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2016-02-12
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