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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...

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Autores principales: Chesna, Aaron M., Cox, Jordan M., Basso, Sanjukta, Benedict, Jason B.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2017
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.
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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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