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Redetermination of the solvent-free crystal structure of l-proline
The title compound, (S)-pyrrolidine-2-carboxylic acid (C(5)H(9)NO(2)), commonly known as l-proline, crystallized without the inclusion of any solvent or water molecules through the slow diffusion of diethyl ether into a saturated solution of l-proline in ethanol. l-Proline crystallized in its zwi...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
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International Union of Crystallography
2018
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6072995/ https://www.ncbi.nlm.nih.gov/pubmed/30116563 http://dx.doi.org/10.1107/S2056989018009490 |
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author | Koenig, Jonas J. Neudörfl, Jörg-M. Hansen, Anne Breugst, Martin |
author_facet | Koenig, Jonas J. Neudörfl, Jörg-M. Hansen, Anne Breugst, Martin |
author_sort | Koenig, Jonas J. |
collection | PubMed |
description | The title compound, (S)-pyrrolidine-2-carboxylic acid (C(5)H(9)NO(2)), commonly known as l-proline, crystallized without the inclusion of any solvent or water molecules through the slow diffusion of diethyl ether into a saturated solution of l-proline in ethanol. l-Proline crystallized in its zwitterionic form and the molecules are linked via N—H⋯O hydrogen bonds, resulting in a two-dimensional network. In comparison to the only other publication of a single-crystal structure of l-proline without inclusions [Kayushina & Vainshtein (1965 ▸). Kristallografiya, 10, 833–844], the R (1) value is significantly improved (0.039 versus 0.169) and thus, our data provides higher precision structural information. |
format | Online Article Text |
id | pubmed-6072995 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2018 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-60729952018-08-16 Redetermination of the solvent-free crystal structure of l-proline Koenig, Jonas J. Neudörfl, Jörg-M. Hansen, Anne Breugst, Martin Acta Crystallogr E Crystallogr Commun Research Communications The title compound, (S)-pyrrolidine-2-carboxylic acid (C(5)H(9)NO(2)), commonly known as l-proline, crystallized without the inclusion of any solvent or water molecules through the slow diffusion of diethyl ether into a saturated solution of l-proline in ethanol. l-Proline crystallized in its zwitterionic form and the molecules are linked via N—H⋯O hydrogen bonds, resulting in a two-dimensional network. In comparison to the only other publication of a single-crystal structure of l-proline without inclusions [Kayushina & Vainshtein (1965 ▸). Kristallografiya, 10, 833–844], the R (1) value is significantly improved (0.039 versus 0.169) and thus, our data provides higher precision structural information. International Union of Crystallography 2018-07-10 /pmc/articles/PMC6072995/ /pubmed/30116563 http://dx.doi.org/10.1107/S2056989018009490 Text en © Koenig et al. 2018 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 Koenig, Jonas J. Neudörfl, Jörg-M. Hansen, Anne Breugst, Martin Redetermination of the solvent-free crystal structure of l-proline |
title | Redetermination of the solvent-free crystal structure of l-proline |
title_full | Redetermination of the solvent-free crystal structure of l-proline |
title_fullStr | Redetermination of the solvent-free crystal structure of l-proline |
title_full_unstemmed | Redetermination of the solvent-free crystal structure of l-proline |
title_short | Redetermination of the solvent-free crystal structure of l-proline |
title_sort | redetermination of the solvent-free crystal structure of l-proline |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6072995/ https://www.ncbi.nlm.nih.gov/pubmed/30116563 http://dx.doi.org/10.1107/S2056989018009490 |
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