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{[CuSn5Sb3]2−}2: A Dimer of Inhomogeneous Superatoms
Authors:Dr Robert J Wilson  Dr Lies Broeckaert  M?Sc Fabian Spitzer  Priv‐Doz?Dr Florian Weigend  Prof?Dr Stefanie Dehnen
Institution:1. Fachbereich Chemie und Wissenschaftliches Zentrum für Materialwissenschaften, Philipps-Universit?t Marburg, Marburg, Germany;2. Institut für Physikalische Chemie, Karlsruher Institut für Technologie (KIT), Karlsruhe, Germany;3. Institut für Anorganische Chemie, Universit?t Regensburg, Regensburg, Germany;4. Institut für Nanotechnologie, Karlsruher Institut für Technologie, Eggenstein-Leopoldshafen, Germany
Abstract:Reaction of the binary Zintl anion (Sn2Sb2)2? with the β‐diketiminato complex LCu(NCMe)] (L=nacnac=(N(C6H3iPr2‐2,6)C(Me))2CH]?) in ethylenediamine or DMF affords the ternary cluster dimer {CuSn5Sb3]2?}2 ( 1 ) as its K(crypt‐222)]+ salt. The chemical formulation of 1 is supported by energy‐dispersive X‐ray spectroscopy (EDX) and quantum chemical calculations. Each monomeric part of the dimer represents a trimetallic “CuSn5Sb3]2?” cluster, with an architecture in between a tricapped trigonal prism and a capped square antiprism. As shown by quantum chemical investigations, the presence of Sb atoms and, in particular, of Cu atoms in the cluster skeleton makes the monomeric unit behave like an inhomogeneous superatom, which clearly prefers to dimerize, thereby producing a relatively short, yet virtually non‐bonding Cu???Cu distance.
Keywords:antimony  cluster compounds  copper  DFT calculations  tin
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