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(±)-Cyclohexane-1,2-diyl bis(4-nitrobenzoate)
The crystal structure of the title compound, C(20)H(18)N(2)O(8), has been investigated to establish the relative stereochemistry between the ester groups. The cyclohexane ring adopts a chair conformation, in which the two ester groups occupy the adjacent equatorial positions in a trans relationship...
Autores principales: | , , , , |
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Formato: | Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2008
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2959677/ https://www.ncbi.nlm.nih.gov/pubmed/21581034 http://dx.doi.org/10.1107/S1600536808033874 |
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author | Tong, Sok Teng Barker, David Choi, Ka Wai Boyd, Peter D. W. Brimble, Margaret A. |
author_facet | Tong, Sok Teng Barker, David Choi, Ka Wai Boyd, Peter D. W. Brimble, Margaret A. |
author_sort | Tong, Sok Teng |
collection | PubMed |
description | The crystal structure of the title compound, C(20)H(18)N(2)O(8), has been investigated to establish the relative stereochemistry between the ester groups. The cyclohexane ring adopts a chair conformation, in which the two ester groups occupy the adjacent equatorial positions in a trans relationship with each other. The molecules assemble in the crystal as chains along the c axis via C—H⋯π interactions between the cyclohexane ring and a pair of nitrophenyl rings of the neighbouring molecule. Also observed are π–π stacking interactions between the nitrophenyl rings of neighbouring chains, with a perpendicular distance between these rings of 3.409 Å and a slippage of 0.969 Å. |
format | Text |
id | pubmed-2959677 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2008 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-29596772010-12-30 (±)-Cyclohexane-1,2-diyl bis(4-nitrobenzoate) Tong, Sok Teng Barker, David Choi, Ka Wai Boyd, Peter D. W. Brimble, Margaret A. Acta Crystallogr Sect E Struct Rep Online Organic Papers The crystal structure of the title compound, C(20)H(18)N(2)O(8), has been investigated to establish the relative stereochemistry between the ester groups. The cyclohexane ring adopts a chair conformation, in which the two ester groups occupy the adjacent equatorial positions in a trans relationship with each other. The molecules assemble in the crystal as chains along the c axis via C—H⋯π interactions between the cyclohexane ring and a pair of nitrophenyl rings of the neighbouring molecule. Also observed are π–π stacking interactions between the nitrophenyl rings of neighbouring chains, with a perpendicular distance between these rings of 3.409 Å and a slippage of 0.969 Å. International Union of Crystallography 2008-10-22 /pmc/articles/PMC2959677/ /pubmed/21581034 http://dx.doi.org/10.1107/S1600536808033874 Text en © Tong et al. 2008 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 Tong, Sok Teng Barker, David Choi, Ka Wai Boyd, Peter D. W. Brimble, Margaret A. (±)-Cyclohexane-1,2-diyl bis(4-nitrobenzoate) |
title | (±)-Cyclohexane-1,2-diyl bis(4-nitrobenzoate) |
title_full | (±)-Cyclohexane-1,2-diyl bis(4-nitrobenzoate) |
title_fullStr | (±)-Cyclohexane-1,2-diyl bis(4-nitrobenzoate) |
title_full_unstemmed | (±)-Cyclohexane-1,2-diyl bis(4-nitrobenzoate) |
title_short | (±)-Cyclohexane-1,2-diyl bis(4-nitrobenzoate) |
title_sort | (±)-cyclohexane-1,2-diyl bis(4-nitrobenzoate) |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2959677/ https://www.ncbi.nlm.nih.gov/pubmed/21581034 http://dx.doi.org/10.1107/S1600536808033874 |
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