Bis­(2-hy­droxy­eth­yl)ammonium 2-bromo­phenolate

In the crystal structure of the 1:1 title salt, C(4)H(12)NO(2) (+)·C(6)H(4)BrO(−), hydrogen-bonding inter­actions originate from the ammonium cation, which adopts a syn conformation. A gauche relationship between the C—O and C—N bonds of the 2-hy­droxy­ethyl fragments also facilitates O—H⋯O inter­ac...

Descripción completa

Detalles Bibliográficos
Autores principales: Padayachy, Kamentheren, Fernandes, Manuel A., Marques, Helder M., Lemmerer, Andreas, de Sousa, Alvaro S.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3435641/
https://www.ncbi.nlm.nih.gov/pubmed/22969514
http://dx.doi.org/10.1107/S1600536812033752
_version_ 1782242558757306368
author Padayachy, Kamentheren
Fernandes, Manuel A.
Marques, Helder M.
Lemmerer, Andreas
de Sousa, Alvaro S.
author_facet Padayachy, Kamentheren
Fernandes, Manuel A.
Marques, Helder M.
Lemmerer, Andreas
de Sousa, Alvaro S.
author_sort Padayachy, Kamentheren
collection PubMed
description In the crystal structure of the 1:1 title salt, C(4)H(12)NO(2) (+)·C(6)H(4)BrO(−), hydrogen-bonding inter­actions originate from the ammonium cation, which adopts a syn conformation. A gauche relationship between the C—O and C—N bonds of the 2-hy­droxy­ethyl fragments also facilitates O—H⋯O inter­actions of bis­(2-hy­droxy­eth­yl)ammonium cation chains to phenolate O atoms. The resulting double-ion chains along [100] are further linked by N—H⋯O inter­actions, forming chains parallel to [110].
format Online
Article
Text
id pubmed-3435641
institution National Center for Biotechnology Information
language English
publishDate 2012
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-34356412012-09-11 Bis­(2-hy­droxy­eth­yl)ammonium 2-bromo­phenolate Padayachy, Kamentheren Fernandes, Manuel A. Marques, Helder M. Lemmerer, Andreas de Sousa, Alvaro S. Acta Crystallogr Sect E Struct Rep Online Organic Papers In the crystal structure of the 1:1 title salt, C(4)H(12)NO(2) (+)·C(6)H(4)BrO(−), hydrogen-bonding inter­actions originate from the ammonium cation, which adopts a syn conformation. A gauche relationship between the C—O and C—N bonds of the 2-hy­droxy­ethyl fragments also facilitates O—H⋯O inter­actions of bis­(2-hy­droxy­eth­yl)ammonium cation chains to phenolate O atoms. The resulting double-ion chains along [100] are further linked by N—H⋯O inter­actions, forming chains parallel to [110]. International Union of Crystallography 2012-08-01 /pmc/articles/PMC3435641/ /pubmed/22969514 http://dx.doi.org/10.1107/S1600536812033752 Text en © Padayachy et al. 2012 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.
spellingShingle Organic Papers
Padayachy, Kamentheren
Fernandes, Manuel A.
Marques, Helder M.
Lemmerer, Andreas
de Sousa, Alvaro S.
Bis­(2-hy­droxy­eth­yl)ammonium 2-bromo­phenolate
title Bis­(2-hy­droxy­eth­yl)ammonium 2-bromo­phenolate
title_full Bis­(2-hy­droxy­eth­yl)ammonium 2-bromo­phenolate
title_fullStr Bis­(2-hy­droxy­eth­yl)ammonium 2-bromo­phenolate
title_full_unstemmed Bis­(2-hy­droxy­eth­yl)ammonium 2-bromo­phenolate
title_short Bis­(2-hy­droxy­eth­yl)ammonium 2-bromo­phenolate
title_sort bis­(2-hy­droxy­eth­yl)ammonium 2-bromo­phenolate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3435641/
https://www.ncbi.nlm.nih.gov/pubmed/22969514
http://dx.doi.org/10.1107/S1600536812033752
work_keys_str_mv AT padayachykamentheren bis2hydroxyethylammonium2bromophenolate
AT fernandesmanuela bis2hydroxyethylammonium2bromophenolate
AT marqueshelderm bis2hydroxyethylammonium2bromophenolate
AT lemmererandreas bis2hydroxyethylammonium2bromophenolate
AT desousaalvaros bis2hydroxyethylammonium2bromophenolate

Ejemplares similares