The Surprising Crystal Packing of Chlorinefluoride

Angewandte Chemie (International Edition in English)

Volumn 36, Issue 13-14, 1997, Pages 1489-1492

  Boese, Roland ^a   Daniel Boese, A ^b   Bläser, Dieter ^a   Antipin, Michail Yu ^a,d   Ellern, Arkadi ^c,e   Seppelt, Konrad ^c  

^a Inst fur Anorganische Chem der U   (Germany)

^b RICE UNIVERSITY   (United States)

^c FREIE UNIVERSITÄT BERLIN   (Germany)

^d A N NESMEYANOV INSTITUTE OF ORGANOELEMENT COMPOUNDS   (Russian Federation)

^e BEN GURION UNIVERSITY OF THE NEGEV   (Israel)

Author keywords

Ab initio calculations; Chlorine; Fluorine; Interhalogen compounds; Solid state structures

Indexed keywords

EID: 0030794770     PISSN: 05700833     EISSN: None     Source Type: Journal    
DOI: 10.1002/anie.199714891     Document Type: Article

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48. o>4.0σ(F)) reflections was used in further calculations. The structure was solved and refined (on F) in the anisotropic approximation (SHELXTL Plus programs Version 4.2) to R = 0.0357, Rw = 0.0401, and GOF = 1.73. Further details of the crystal structure investigation may be obtained from the Fachin-formationszentrum Karlsruhe, D-76344 Eggenstein-Leopoldshafen (Germany), on quoting the depository number CSD-406442.