| Literature DB >> 17609574 |
Wilson Cunico1, Claudia R B Gomes, Solange M S V Wardell, John N Low, Christopher Glidewell.
Abstract
rac-2-Isopropyl-3-(2-nitrobenzyl)-1,3-thiadiazolin-4-one, C(13)H(16)N(2)O(3)S, is a rare example of a racemate crystallizing in the space group P2(1)2(1)2(1), with one molecule each of S and R configurations, whose conformations are almost mirror images, within the asymmetric unit. The molecules of S configuration are linked by two C-H...O hydrogen bonds into a three-dimensional framework, and the molecules of R configuration are linked by two further C-H...O hydrogen bonds into a different type of three-dimensional framework; the two frameworks are linked by a fifth C-H...O hydrogen bond.Entities:
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Year: 2007 PMID: 17609574 DOI: 10.1107/S0108270107022913
Source DB: PubMed Journal: Acta Crystallogr C ISSN: 0108-2701 Impact factor: 1.172