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-3. For detailed information see Supporting information. CCDC 926102 {will be inserted prior to publication} (4b) contains the supplementary crystallographic data for this compound. The data of 4a and 4b can be obtained free of charge from The Cambridge Crystallographic Data Centre via www.ccdc.cam.ac.uk/data-request/cif.
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Due to the strongly oxidizing nature of compound 1, an equivalent of cyclohexene had to be added to the reaction in order to quench the elemental bromine that was formed by oxidation of bromide. We have seen no similar reactivity for compounds 4a and 4b
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Bidentate coordination to bromide was chosen in both cases for the sake of comparison. In solution, monodentate binding of bromide to the halogen-bond donors might also occur, but the trends found for the bidentate binding should also apply to the monodentate complexes
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Bidentate coordination to bromide was chosen in both cases for the sake of comparison. In solution, monodentate binding of bromide to the halogen-bond donors might also occur, but the trends found for the bidentate binding should also apply to the monodentate complexes.
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