Acridinium 6-carboxypyridine-2-carboxylate monohydrate
The title compound, C13H10N+·C7H4NO4 −·H2O or (acrH)+(pydcH)−·H2O, is a monohydrate of acridinium cations and a mono-deprotonated pyridine-2,6-dicarboxylic acid. The structure contains a range of non-covalent interactions, such as O—H⋯O, O—H⋯N and N—H⋯O hydrogen bonds, as well as π...
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| Format: | Online |
| Language: | English |
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International Union of Crystallography
2011
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| Online Access: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3051510/ |
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pubmed-3051510 |
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pubmed-30515102011-04-26 Acridinium 6-carboxypyridine-2-carboxylate monohydrate Derikvand, Zohreh Olmstead, Marilyn M. Attar Gharamaleki, Jafar Organic Papers The title compound, C13H10N+·C7H4NO4 −·H2O or (acrH)+(pydcH)−·H2O, is a monohydrate of acridinium cations and a mono-deprotonated pyridine-2,6-dicarboxylic acid. The structure contains a range of non-covalent interactions, such as O—H⋯O, O—H⋯N and N—H⋯O hydrogen bonds, as well as π–π stacking [range of centroid–centroid distances = 3.4783 (5)–3.8059 (5) Å]. The N—H⋯O hydrogen bond between the donor acridinium cation and the carboxylate acceptor is particularly strong. The average separation between the π-stacked acridinium planes is 3.42 (3) Å. International Union of Crystallography 2011-01-15 /pmc/articles/PMC3051510/ /pubmed/21523086 http://dx.doi.org/10.1107/S1600536810053791 Text en © Derikvand et al. 2011 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. |
| repository_type |
Open Access Journal |
| institution_category |
Foreign Institution |
| institution |
US National Center for Biotechnology Information |
| building |
NCBI PubMed |
| collection |
Online Access |
| language |
English |
| format |
Online |
| author |
Derikvand, Zohreh Olmstead, Marilyn M. Attar Gharamaleki, Jafar |
| spellingShingle |
Derikvand, Zohreh Olmstead, Marilyn M. Attar Gharamaleki, Jafar Acridinium 6-carboxypyridine-2-carboxylate monohydrate |
| author_facet |
Derikvand, Zohreh Olmstead, Marilyn M. Attar Gharamaleki, Jafar |
| author_sort |
Derikvand, Zohreh |
| title |
Acridinium 6-carboxypyridine-2-carboxylate monohydrate |
| title_short |
Acridinium 6-carboxypyridine-2-carboxylate monohydrate |
| title_full |
Acridinium 6-carboxypyridine-2-carboxylate monohydrate |
| title_fullStr |
Acridinium 6-carboxypyridine-2-carboxylate monohydrate |
| title_full_unstemmed |
Acridinium 6-carboxypyridine-2-carboxylate monohydrate |
| title_sort |
acridinium 6-carboxypyridine-2-carboxylate monohydrate |
| description |
The title compound, C13H10N+·C7H4NO4
−·H2O or (acrH)+(pydcH)−·H2O, is a monohydrate of acridinium cations and a mono-deprotonated pyridine-2,6-dicarboxylic acid. The structure contains a range of non-covalent interactions, such as O—H⋯O, O—H⋯N and N—H⋯O hydrogen bonds, as well as π–π stacking [range of centroid–centroid distances = 3.4783 (5)–3.8059 (5) Å]. The N—H⋯O hydrogen bond between the donor acridinium cation and the carboxylate acceptor is particularly strong. The average separation between the π-stacked acridinium planes is 3.42 (3) Å. |
| publisher |
International Union of Crystallography |
| publishDate |
2011 |
| url |
https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3051510/ |
| _version_ |
1611443625712943104 |