Cargando…

Crystal structure of bis­(3-carb­oxy-1-methyl­pyrid­inium) octa­bromide

The crystal structure of the title salt, bis­(3-carb­oxy-1-methyl­pyridinium) octa­bromide, 2C(7)H(8)NO(2) (+)·Br(8) (2−), consists of 3-carb­oxy-1-methyl­pyridinium (N-methyl­nicotinic acid) cations, which are stacked between relatively rare [Br(8)](2–) anions. The polybromide [Br(8)](2–) anion has...

Descripción completa

Detalles Bibliográficos
Autores principales: Sirenko, Valerii Y., Naumova, Dina D., Golenya, Irina A., Shova, Sergiu, Gural’skiy, Il’ya A.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10626950/
https://www.ncbi.nlm.nih.gov/pubmed/37936849
http://dx.doi.org/10.1107/S2056989023008460
_version_ 1785131438269530112
author Sirenko, Valerii Y.
Naumova, Dina D.
Golenya, Irina A.
Shova, Sergiu
Gural’skiy, Il’ya A.
author_facet Sirenko, Valerii Y.
Naumova, Dina D.
Golenya, Irina A.
Shova, Sergiu
Gural’skiy, Il’ya A.
author_sort Sirenko, Valerii Y.
collection PubMed
description The crystal structure of the title salt, bis­(3-carb­oxy-1-methyl­pyridinium) octa­bromide, 2C(7)H(8)NO(2) (+)·Br(8) (2−), consists of 3-carb­oxy-1-methyl­pyridinium (N-methyl­nicotinic acid) cations, which are stacked between relatively rare [Br(8)](2–) anions. The polybromide [Br(8)](2–) anion has point group symmetry [Image: see text] and can be described as being composed of two [Br(3)](−) anions connected with a Br(2) mol­ecule in a Z-shaped manner. Contacts between neighboring octa­bromide anions ensure the creation of pseudo-polymeric chains propagating along [111]. The organic cations are located between anionic chains and are connected to each other through O—H⋯O hydrogen bonds and to the [Br(8)](2–) anions through π⋯Br inter­actions that induce the creation of a supra­molecular tri-periodic network. In addition, the presence of weak C—H⋯Br contacts leads to the creation of layers, which align parallel to (11 [Image: see text] ).
format Online
Article
Text
id pubmed-10626950
institution National Center for Biotechnology Information
language English
publishDate 2023
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-106269502023-11-07 Crystal structure of bis­(3-carb­oxy-1-methyl­pyrid­inium) octa­bromide Sirenko, Valerii Y. Naumova, Dina D. Golenya, Irina A. Shova, Sergiu Gural’skiy, Il’ya A. Acta Crystallogr E Crystallogr Commun Research Communications The crystal structure of the title salt, bis­(3-carb­oxy-1-methyl­pyridinium) octa­bromide, 2C(7)H(8)NO(2) (+)·Br(8) (2−), consists of 3-carb­oxy-1-methyl­pyridinium (N-methyl­nicotinic acid) cations, which are stacked between relatively rare [Br(8)](2–) anions. The polybromide [Br(8)](2–) anion has point group symmetry [Image: see text] and can be described as being composed of two [Br(3)](−) anions connected with a Br(2) mol­ecule in a Z-shaped manner. Contacts between neighboring octa­bromide anions ensure the creation of pseudo-polymeric chains propagating along [111]. The organic cations are located between anionic chains and are connected to each other through O—H⋯O hydrogen bonds and to the [Br(8)](2–) anions through π⋯Br inter­actions that induce the creation of a supra­molecular tri-periodic network. In addition, the presence of weak C—H⋯Br contacts leads to the creation of layers, which align parallel to (11 [Image: see text] ). International Union of Crystallography 2023-10-03 /pmc/articles/PMC10626950/ /pubmed/37936849 http://dx.doi.org/10.1107/S2056989023008460 Text en © Sirenko et al. 2023 https://creativecommons.org/licenses/by/4.0/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.
spellingShingle Research Communications
Sirenko, Valerii Y.
Naumova, Dina D.
Golenya, Irina A.
Shova, Sergiu
Gural’skiy, Il’ya A.
Crystal structure of bis­(3-carb­oxy-1-methyl­pyrid­inium) octa­bromide
title Crystal structure of bis­(3-carb­oxy-1-methyl­pyrid­inium) octa­bromide
title_full Crystal structure of bis­(3-carb­oxy-1-methyl­pyrid­inium) octa­bromide
title_fullStr Crystal structure of bis­(3-carb­oxy-1-methyl­pyrid­inium) octa­bromide
title_full_unstemmed Crystal structure of bis­(3-carb­oxy-1-methyl­pyrid­inium) octa­bromide
title_short Crystal structure of bis­(3-carb­oxy-1-methyl­pyrid­inium) octa­bromide
title_sort crystal structure of bis­(3-carb­oxy-1-methyl­pyrid­inium) octa­bromide
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10626950/
https://www.ncbi.nlm.nih.gov/pubmed/37936849
http://dx.doi.org/10.1107/S2056989023008460
work_keys_str_mv AT sirenkovaleriiy crystalstructureofbis3carboxy1methylpyridiniumoctabromide
AT naumovadinad crystalstructureofbis3carboxy1methylpyridiniumoctabromide
AT golenyairinaa crystalstructureofbis3carboxy1methylpyridiniumoctabromide
AT shovasergiu crystalstructureofbis3carboxy1methylpyridiniumoctabromide
AT guralskiyilyaa crystalstructureofbis3carboxy1methylpyridiniumoctabromide