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Hydrogen-bonded co-crystal structure of benzoic acid and zwitterionic l-proline
The title compound [systematic name: benzoic acid–pyrrolidin-1-ium-2-carboxylate (1/1)], C(7)H(6)O(2)·C(5)H(9)NO(2), is an example of the application of non-centrosymmetric co-crystallization for the growth of a crystal containing a typically centrosymmetric component in a chiral space group. It co...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2017
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5347056/ https://www.ncbi.nlm.nih.gov/pubmed/28316811 http://dx.doi.org/10.1107/S2056989017001785 |
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author | Chesna, Aaron M. Cox, Jordan M. Basso, Sanjukta Benedict, Jason B. |
author_facet | Chesna, Aaron M. Cox, Jordan M. Basso, Sanjukta Benedict, Jason B. |
author_sort | Chesna, Aaron M. |
collection | PubMed |
description | The title compound [systematic name: benzoic acid–pyrrolidin-1-ium-2-carboxylate (1/1)], C(7)H(6)O(2)·C(5)H(9)NO(2), is an example of the application of non-centrosymmetric co-crystallization for the growth of a crystal containing a typically centrosymmetric component in a chiral space group. It co-crystallizes in the space group P2(1)2(1)2(1) and contains benzoic acid and l-proline in equal proportions. The crystal structure exhibits chains of l-proline zwitterions capped by benzoic acid molecules which form a C(5)[R (3) (3)(11)] hydrogen-bonded network along [100]. The crystal structure is examined and compared to that of a similar co-crystal containing l-proline zwitterions and 4-aminobenzoic acid. |
format | Online Article Text |
id | pubmed-5347056 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2017 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-53470562017-03-17 Hydrogen-bonded co-crystal structure of benzoic acid and zwitterionic l-proline Chesna, Aaron M. Cox, Jordan M. Basso, Sanjukta Benedict, Jason B. Acta Crystallogr E Crystallogr Commun Research Communications The title compound [systematic name: benzoic acid–pyrrolidin-1-ium-2-carboxylate (1/1)], C(7)H(6)O(2)·C(5)H(9)NO(2), is an example of the application of non-centrosymmetric co-crystallization for the growth of a crystal containing a typically centrosymmetric component in a chiral space group. It co-crystallizes in the space group P2(1)2(1)2(1) and contains benzoic acid and l-proline in equal proportions. The crystal structure exhibits chains of l-proline zwitterions capped by benzoic acid molecules which form a C(5)[R (3) (3)(11)] hydrogen-bonded network along [100]. The crystal structure is examined and compared to that of a similar co-crystal containing l-proline zwitterions and 4-aminobenzoic acid. International Union of Crystallography 2017-02-14 /pmc/articles/PMC5347056/ /pubmed/28316811 http://dx.doi.org/10.1107/S2056989017001785 Text en © Chesna et al. 2017 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.http://creativecommons.org/licenses/by/2.0/uk/ |
spellingShingle | Research Communications Chesna, Aaron M. Cox, Jordan M. Basso, Sanjukta Benedict, Jason B. Hydrogen-bonded co-crystal structure of benzoic acid and zwitterionic l-proline |
title | Hydrogen-bonded co-crystal structure of benzoic acid and zwitterionic l-proline |
title_full | Hydrogen-bonded co-crystal structure of benzoic acid and zwitterionic l-proline |
title_fullStr | Hydrogen-bonded co-crystal structure of benzoic acid and zwitterionic l-proline |
title_full_unstemmed | Hydrogen-bonded co-crystal structure of benzoic acid and zwitterionic l-proline |
title_short | Hydrogen-bonded co-crystal structure of benzoic acid and zwitterionic l-proline |
title_sort | hydrogen-bonded co-crystal structure of benzoic acid and zwitterionic l-proline |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5347056/ https://www.ncbi.nlm.nih.gov/pubmed/28316811 http://dx.doi.org/10.1107/S2056989017001785 |
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