Crystal structure analysis of 1,1,4,4-tetrafluorobutadiene and experimental determination of the charge density of 1,1,4,4-tetrafluorobutatriene

Ansgar Bach, Dieter Lentz, Peter Luger, Marc Messerschmidt, Christian Olesch, Mona Patzschke

Research output: Contribution to journalArticle

30 Citations (Scopus)

Abstract

Despite its high instability, the cumulene 1,1,4,4-tetrafluorobutatriene was obtained in a crystalline form. Its X-ray structure characterization revealed the presence of a herringbone motif in the solid state (see picture). Experimental and calculated charge desity distributions show, as expected, that the central double bond is shorter and displays a higher charge density than the two outer double bonds.

Original languageEnglish (US)
Pages (from-to)296-299
Number of pages4
JournalAngewandte Chemie - International Edition
Volume41
Issue number2
DOIs
StatePublished - Jan 18 2002
Externally publishedYes

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Charge distribution
Charge density
Crystal structure
Crystalline materials
X rays

Keywords

  • C-C coupling
  • Charge density
  • Cumulenes
  • Solid-state structures
  • X-ray diffraction

ASJC Scopus subject areas

  • Catalysis
  • Chemistry(all)

Cite this

Crystal structure analysis of 1,1,4,4-tetrafluorobutadiene and experimental determination of the charge density of 1,1,4,4-tetrafluorobutatriene. / Bach, Ansgar; Lentz, Dieter; Luger, Peter; Messerschmidt, Marc; Olesch, Christian; Patzschke, Mona.

In: Angewandte Chemie - International Edition, Vol. 41, No. 2, 18.01.2002, p. 296-299.

Research output: Contribution to journalArticle

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