1,2,3,4,5,6,7,8,13,13,14,14-Dodecachloro-1,4,4a,4b,5,8,8a,12b-octahydro-1,4:5,8-dimethanotriphenylene at 90 #8197;KCAS 147730-93-6

The previously reported room-temperature crystal structure [Jaud Baldy, Negrel, Poite & Chanon (1993). Z. Kristallogr. 204, 289–291] of the title compound, C20H8Cl12, is monoclinic with Z′ = 1, whereas the 90 K structure reported herein is triclinic with Z&#...

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Bibliographic Details
Published inActa crystallographica. Section E, Structure reports online Vol. 68; no. 8; p. o2538
Main Authors Brandon W. Jenkins, Frank R. Fronczek, Steven F. Watkins
Format Journal Article
LanguageEnglish
Published International Union of Crystallography 01.08.2012
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Summary:The previously reported room-temperature crystal structure [Jaud Baldy, Negrel, Poite & Chanon (1993). Z. Kristallogr. 204, 289–291] of the title compound, C20H8Cl12, is monoclinic with Z′ = 1, whereas the 90 K structure reported herein is triclinic with Z′ = 2 and shows a 2% volume contraction. The crystallographically independent unit chosen consists of both enantiomers (Λ and Δ) of this propeller-like molecule. Both enantiomers display quasi-twofold symmetry, with average bond-length/bond-angle deviations of 0.0018 (4) Å and 0.41 (2)° for Λ, and 0.0026 (4) Å and 0.50 (2)° for Δ.
ISSN:1600-5368
1600-5368
DOI:10.1107/S1600536812032540