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Dicyclo­hexyl­ammonium thio­cyanate: monoclinic polymorph

The title salt, C(12)H(24)N(+)·NCS(−), represents a monoclinic polymorph of the previously reported ortho­rhom­bic form [Khawar Rauf et al. (2008 ▶). Acta Cryst. E64, o366]. Two independent formula units comprise the asymmetric unit with the major difference in their mol­ecular structures relating t...

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Autores principales: Selvakumaran, N., Karvembu, R., Ng, Seik Weng, Tiekink, Edward R. T.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3247581/
https://www.ncbi.nlm.nih.gov/pubmed/22219886
http://dx.doi.org/10.1107/S1600536811040001
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author Selvakumaran, N.
Karvembu, R.
Ng, Seik Weng
Tiekink, Edward R. T.
author_facet Selvakumaran, N.
Karvembu, R.
Ng, Seik Weng
Tiekink, Edward R. T.
author_sort Selvakumaran, N.
collection PubMed
description The title salt, C(12)H(24)N(+)·NCS(−), represents a monoclinic polymorph of the previously reported ortho­rhom­bic form [Khawar Rauf et al. (2008 ▶). Acta Cryst. E64, o366]. Two independent formula units comprise the asymmetric unit with the major difference in their mol­ecular structures relating to the relative dispositions of the cyclo­hexyl rings [dihedral angles = 79.88 (6) and 67.72 (5)°]. Further, the independent anions form distinctive patterns of hydrogen-bonding inter­actions, i.e. 2 × N—H⋯N versus N—H⋯N and N—H⋯S. The resulting supra­molecular architecture is a supra­molecular chain along the c axis based on a square-wave topology.
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spelling pubmed-32475812012-01-04 Dicyclo­hexyl­ammonium thio­cyanate: monoclinic polymorph Selvakumaran, N. Karvembu, R. Ng, Seik Weng Tiekink, Edward R. T. Acta Crystallogr Sect E Struct Rep Online Organic Papers The title salt, C(12)H(24)N(+)·NCS(−), represents a monoclinic polymorph of the previously reported ortho­rhom­bic form [Khawar Rauf et al. (2008 ▶). Acta Cryst. E64, o366]. Two independent formula units comprise the asymmetric unit with the major difference in their mol­ecular structures relating to the relative dispositions of the cyclo­hexyl rings [dihedral angles = 79.88 (6) and 67.72 (5)°]. Further, the independent anions form distinctive patterns of hydrogen-bonding inter­actions, i.e. 2 × N—H⋯N versus N—H⋯N and N—H⋯S. The resulting supra­molecular architecture is a supra­molecular chain along the c axis based on a square-wave topology. International Union of Crystallography 2011-10-05 /pmc/articles/PMC3247581/ /pubmed/22219886 http://dx.doi.org/10.1107/S1600536811040001 Text en © Selvakumaran et al. 2011 http://creativecommons.org/licenses/by/2.0/uk/ 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.
spellingShingle Organic Papers
Selvakumaran, N.
Karvembu, R.
Ng, Seik Weng
Tiekink, Edward R. T.
Dicyclo­hexyl­ammonium thio­cyanate: monoclinic polymorph
title Dicyclo­hexyl­ammonium thio­cyanate: monoclinic polymorph
title_full Dicyclo­hexyl­ammonium thio­cyanate: monoclinic polymorph
title_fullStr Dicyclo­hexyl­ammonium thio­cyanate: monoclinic polymorph
title_full_unstemmed Dicyclo­hexyl­ammonium thio­cyanate: monoclinic polymorph
title_short Dicyclo­hexyl­ammonium thio­cyanate: monoclinic polymorph
title_sort dicyclo­hexyl­ammonium thio­cyanate: monoclinic polymorph
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3247581/
https://www.ncbi.nlm.nih.gov/pubmed/22219886
http://dx.doi.org/10.1107/S1600536811040001
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