Benzyl 2-(4-bromo­anilino)-4,4-dimethyl-6-oxocyclo­hex-1-enecarbodithio­ate: first triclinic polymorph

The six-membered cyclo­hexene ring in the title compound, C(22)H(22)BrNOS(2), adopts an envelope conformation, with the C atom bearing the two methyl groups representing the flap. This atom deviates by 0.686 (4) Å from the plane passing through the other five atoms of the ring (r.m.s. deviation = 0....

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Detalles Bibliográficos
Autores principales: El Ashry, El Sayed H., Amer, Mohammed R., Raza Shah, Muhammad, Ng, Seik Weng
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2009
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2968658/
https://www.ncbi.nlm.nih.gov/pubmed/21582251
http://dx.doi.org/10.1107/S160053680900614X
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author El Ashry, El Sayed H.
Amer, Mohammed R.
Raza Shah, Muhammad
Ng, Seik Weng
author_facet El Ashry, El Sayed H.
Amer, Mohammed R.
Raza Shah, Muhammad
Ng, Seik Weng
author_sort El Ashry, El Sayed H.
collection PubMed
description The six-membered cyclo­hexene ring in the title compound, C(22)H(22)BrNOS(2), adopts an envelope conformation, with the C atom bearing the two methyl groups representing the flap. This atom deviates by 0.686 (4) Å from the plane passing through the other five atoms of the ring (r.m.s. deviation = 0.025 Å). The mol­ecular conformation is stabilized by an intra­molecular N—H⋯S hydrogen bond.
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spelling pubmed-29686582010-12-30 Benzyl 2-(4-bromo­anilino)-4,4-dimethyl-6-oxocyclo­hex-1-enecarbodithio­ate: first triclinic polymorph El Ashry, El Sayed H. Amer, Mohammed R. Raza Shah, Muhammad Ng, Seik Weng Acta Crystallogr Sect E Struct Rep Online Organic Papers The six-membered cyclo­hexene ring in the title compound, C(22)H(22)BrNOS(2), adopts an envelope conformation, with the C atom bearing the two methyl groups representing the flap. This atom deviates by 0.686 (4) Å from the plane passing through the other five atoms of the ring (r.m.s. deviation = 0.025 Å). The mol­ecular conformation is stabilized by an intra­molecular N—H⋯S hydrogen bond. International Union of Crystallography 2009-02-25 /pmc/articles/PMC2968658/ /pubmed/21582251 http://dx.doi.org/10.1107/S160053680900614X Text en © El Ashry et al. 2009 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
El Ashry, El Sayed H.
Amer, Mohammed R.
Raza Shah, Muhammad
Ng, Seik Weng
Benzyl 2-(4-bromo­anilino)-4,4-dimethyl-6-oxocyclo­hex-1-enecarbodithio­ate: first triclinic polymorph
title Benzyl 2-(4-bromo­anilino)-4,4-dimethyl-6-oxocyclo­hex-1-enecarbodithio­ate: first triclinic polymorph
title_full Benzyl 2-(4-bromo­anilino)-4,4-dimethyl-6-oxocyclo­hex-1-enecarbodithio­ate: first triclinic polymorph
title_fullStr Benzyl 2-(4-bromo­anilino)-4,4-dimethyl-6-oxocyclo­hex-1-enecarbodithio­ate: first triclinic polymorph
title_full_unstemmed Benzyl 2-(4-bromo­anilino)-4,4-dimethyl-6-oxocyclo­hex-1-enecarbodithio­ate: first triclinic polymorph
title_short Benzyl 2-(4-bromo­anilino)-4,4-dimethyl-6-oxocyclo­hex-1-enecarbodithio­ate: first triclinic polymorph
title_sort benzyl 2-(4-bromo­anilino)-4,4-dimethyl-6-oxocyclo­hex-1-enecarbodithio­ate: first triclinic polymorph
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2968658/
https://www.ncbi.nlm.nih.gov/pubmed/21582251
http://dx.doi.org/10.1107/S160053680900614X
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