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(1S*,3R*,5S*,7S*)-4,4,8,8-Tetrachloro-1-isopropyl-5-methyltricyclo[5.1.0.0(3,5)]octane
The title compound, C(12)H(16)Cl(4), is a derivative of the natural product 1-isopropyl-4-methylcyclohexa-1,4-diene, and represents a diastereomer with two trans-fused cyclopropane rings. Both enantiomers are present in the non-centrosymmetric polar space group Pna2(1). The central cyclohexane...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2014
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3998570/ https://www.ncbi.nlm.nih.gov/pubmed/24826130 http://dx.doi.org/10.1107/S1600536814004826 |
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author | Turdybekov, Koblandy M. Ryazantsev, Oleg G. Atazhanova, Gayane A. Adekenov, Sergazy M. |
author_facet | Turdybekov, Koblandy M. Ryazantsev, Oleg G. Atazhanova, Gayane A. Adekenov, Sergazy M. |
author_sort | Turdybekov, Koblandy M. |
collection | PubMed |
description | The title compound, C(12)H(16)Cl(4), is a derivative of the natural product 1-isopropyl-4-methylcyclohexa-1,4-diene, and represents a diastereomer with two trans-fused cyclopropane rings. Both enantiomers are present in the non-centrosymmetric polar space group Pna2(1). The central cyclohexane ring is planar within 0.02 (1) Å. The C atoms of dichloromethylene groups deviate from this plane by 1.19 (1) and −1.26 (1) Å, whereas the isopropyl and methyl groups are oriented more equatorially, deviating by 0.71 (1) and −0.87 (1) Å, respectively. |
format | Online Article Text |
id | pubmed-3998570 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2014 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-39985702014-05-13 (1S*,3R*,5S*,7S*)-4,4,8,8-Tetrachloro-1-isopropyl-5-methyltricyclo[5.1.0.0(3,5)]octane Turdybekov, Koblandy M. Ryazantsev, Oleg G. Atazhanova, Gayane A. Adekenov, Sergazy M. Acta Crystallogr Sect E Struct Rep Online Organic Papers The title compound, C(12)H(16)Cl(4), is a derivative of the natural product 1-isopropyl-4-methylcyclohexa-1,4-diene, and represents a diastereomer with two trans-fused cyclopropane rings. Both enantiomers are present in the non-centrosymmetric polar space group Pna2(1). The central cyclohexane ring is planar within 0.02 (1) Å. The C atoms of dichloromethylene groups deviate from this plane by 1.19 (1) and −1.26 (1) Å, whereas the isopropyl and methyl groups are oriented more equatorially, deviating by 0.71 (1) and −0.87 (1) Å, respectively. International Union of Crystallography 2014-03-12 /pmc/articles/PMC3998570/ /pubmed/24826130 http://dx.doi.org/10.1107/S1600536814004826 Text en © Turdybekov et al. 2014 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 Turdybekov, Koblandy M. Ryazantsev, Oleg G. Atazhanova, Gayane A. Adekenov, Sergazy M. (1S*,3R*,5S*,7S*)-4,4,8,8-Tetrachloro-1-isopropyl-5-methyltricyclo[5.1.0.0(3,5)]octane |
title | (1S*,3R*,5S*,7S*)-4,4,8,8-Tetrachloro-1-isopropyl-5-methyltricyclo[5.1.0.0(3,5)]octane |
title_full | (1S*,3R*,5S*,7S*)-4,4,8,8-Tetrachloro-1-isopropyl-5-methyltricyclo[5.1.0.0(3,5)]octane |
title_fullStr | (1S*,3R*,5S*,7S*)-4,4,8,8-Tetrachloro-1-isopropyl-5-methyltricyclo[5.1.0.0(3,5)]octane |
title_full_unstemmed | (1S*,3R*,5S*,7S*)-4,4,8,8-Tetrachloro-1-isopropyl-5-methyltricyclo[5.1.0.0(3,5)]octane |
title_short | (1S*,3R*,5S*,7S*)-4,4,8,8-Tetrachloro-1-isopropyl-5-methyltricyclo[5.1.0.0(3,5)]octane |
title_sort | (1s*,3r*,5s*,7s*)-4,4,8,8-tetrachloro-1-isopropyl-5-methyltricyclo[5.1.0.0(3,5)]octane |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3998570/ https://www.ncbi.nlm.nih.gov/pubmed/24826130 http://dx.doi.org/10.1107/S1600536814004826 |
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