4.8 Article

Synthesis, Solid-State Structure, and Bonding Analysis of a Homoleptic Beryllium Azide

Journal

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
Volume 56, Issue 29, Pages 8559-8563

Publisher

WILEY-V C H VERLAG GMBH
DOI: 10.1002/anie.201703147

Keywords

azides; beryllium; crystal structures; main group elements; quantum-chemical calculations

Funding

  1. Fonds der Chemischen Industrie (FCI)
  2. University of Duisburg-Essen

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[Ph4P](2)[Be(N-3)(4)] (1) and [PNP](2)[Be(N-3)(4)] (2; PNP= Ph3PNPPh3) were synthesized by reacting Be(N-3)(2) with [Ph4P]N-3 and [PNP]N-3. Compound 1 represents the first structurally characterized homoleptic beryllium azide. The electronic structure and bonding situation in the tetraazidoberyllate dianion [Be(N-3)(4)](2-) were investigated by quantum-chemical calculations (NPA, ELF, LOL).

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