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Issue 32, 2013
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Beryllium chemistry the safe way: a theoretical evaluation of low oxidation state beryllium compounds

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Abstract

A theoretical study of compounds containing Be in the +1 or 0 oxidation state has been carried out. The molecules considered containing Be in the +1 oxidation state are analogues of the important Mg(I)–Mg(I) dimer supported by the β-diketiminate ligand. The molecules in the 0 oxidation state are NHC supported compounds analogous to “molecular allotropes” which has recently become a topic of importance in p-block chemistry. In this case, our results demonstrate that the Be(0) complexes are far more stable than the analogous Mg(0) complexes, highlighting the opportunities afforded in Be chemistry, despite the challenges presented by the toxicity of Be compounds.

Graphical abstract: Beryllium chemistry the safe way: a theoretical evaluation of low oxidation state beryllium compounds

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Publication details

The article was received on 01 Mar 2013, accepted on 02 Apr 2013 and first published on 02 Apr 2013


Article type: Paper
DOI: 10.1039/C3DT50563D
Citation: Dalton Trans., 2013,42, 11375-11384
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    Beryllium chemistry the safe way: a theoretical evaluation of low oxidation state beryllium compounds

    S. A. Couchman, N. Holzmann, G. Frenking, D. J. D. Wilson and J. L. Dutton, Dalton Trans., 2013, 42, 11375
    DOI: 10.1039/C3DT50563D

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