18
views
0
recommends
+1 Recommend
0 collections
    0
    shares
      • Record: found
      • Abstract: found
      • Article: found
      Is Open Access

      2-[4-(2-{5- tert-Butyl-2-chloro-3-[2-(3-pentyl-1,3-benzothia­zol-2-yl­idene)ethyl­idene]cyclo­hex-1-en­yl}ethen­yl)-3-cyano-5,5-dimethyl­furan-2-yl­idene]malono­nitrile

      research-article

      Read this article at

      Bookmark
          There is no author summary for this article yet. Authors can add summaries to their articles on ScienceOpen to make them more accessible to a non-specialist audience.

          Abstract

          In the title mol­ecule, C 36H 39ClN 4OS, the non-aromatic part of the cyclo­hex-1-enyl ring and the attached tert-butyl group are disordered over two conformations with occupancy ratios of 0.52 (3):0.48 (3) and 0.53 (3):0.47 (3), respectively. The polyene chain single- and double-bond dimensions contrast with a closely related compound [Bouit et al. (2007 ). Chem. Mater. 19, 5325–5335] with an approximate 19° twist between donor and acceptor ends of the mol­ecule, related to the additional intra­molecular C—H⋯S inter­action. In the title compound, the mol­ecules pack into dimeric units about centres of symmetry utilizing weak C—H⋯N(cyano) and C—H⋯O attractive inter­actions, building both chain and ring motifs about the centres [ R 2 2(8) and R 2 2(9)]. Adjacent dimeric sets then form a herringbone configuration.

          Related collections

          Author and article information

          Journal
          Acta Crystallogr Sect E Struct Rep Online
          Acta Crystallogr Sect E Struct Rep Online
          Acta Cryst. E
          Acta Crystallographica Section E: Structure Reports Online
          International Union of Crystallography
          1600-5368
          01 January 2013
          22 December 2012
          22 December 2012
          : 69
          : Pt 1 ( publisher-idID: e130100 )
          : o120-o121
          Affiliations
          [a ]Industrial Research Limited, PO Box 31-310, Lower Hutt, New Zealand
          Author notes
          Correspondence e-mail: g.gainsford@ 123456irl.cri.nz
          Article
          bx2431 ACSEBH S1600536812050842
          10.1107/S1600536812050842
          3588378
          23476383
          eccab696-d05d-4f9d-88d4-eac0ad8a3f89
          © Gainsford et al. 2013

          This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.

          History
          : 21 November 2012
          : 13 December 2012
          Categories
          Organic Papers

          Materials characterization
          Materials characterization

          Comments

          Comment on this article