Cargando…
Diethyl(hydroxy)ammonium 3-carboxybenzoate
In the title molecular compound, C(4)H(12)NO(+)·C(8)H(5)O(4) (−), the N,N-diethyl(hydroxy)ammonium cation (DTHA) is linked to the 3-carboxybenzoate anion (HBDL) by O—H⋯O and N—H⋯O hydrogen bonds with a graph-set motif R (2) (2)(7). In the crystal, helical chains are formed by O—H⋯O hydrogen bond...
Autores principales: | , , |
---|---|
Formato: | Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2010
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3007967/ https://www.ncbi.nlm.nih.gov/pubmed/21588674 http://dx.doi.org/10.1107/S1600536810030746 |
_version_ | 1782194470409732096 |
---|---|
author | Guo, Yun Wang, Cong Chen, Hai-Xiang |
author_facet | Guo, Yun Wang, Cong Chen, Hai-Xiang |
author_sort | Guo, Yun |
collection | PubMed |
description | In the title molecular compound, C(4)H(12)NO(+)·C(8)H(5)O(4) (−), the N,N-diethyl(hydroxy)ammonium cation (DTHA) is linked to the 3-carboxybenzoate anion (HBDL) by O—H⋯O and N—H⋯O hydrogen bonds with a graph-set motif R (2) (2)(7). In the crystal, helical chains are formed by O—H⋯O hydrogen bonds, propagating along [010]. The crystal structure is further stabilized by π–π interactions between inversion-related HBDL benzene rings [centroid–centroid distance = 3.900 (4) Å] and C—H⋯O interactions. |
format | Text |
id | pubmed-3007967 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2010 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-30079672010-12-30 Diethyl(hydroxy)ammonium 3-carboxybenzoate Guo, Yun Wang, Cong Chen, Hai-Xiang Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title molecular compound, C(4)H(12)NO(+)·C(8)H(5)O(4) (−), the N,N-diethyl(hydroxy)ammonium cation (DTHA) is linked to the 3-carboxybenzoate anion (HBDL) by O—H⋯O and N—H⋯O hydrogen bonds with a graph-set motif R (2) (2)(7). In the crystal, helical chains are formed by O—H⋯O hydrogen bonds, propagating along [010]. The crystal structure is further stabilized by π–π interactions between inversion-related HBDL benzene rings [centroid–centroid distance = 3.900 (4) Å] and C—H⋯O interactions. International Union of Crystallography 2010-08-18 /pmc/articles/PMC3007967/ /pubmed/21588674 http://dx.doi.org/10.1107/S1600536810030746 Text en © Guo et al. 2010 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 Guo, Yun Wang, Cong Chen, Hai-Xiang Diethyl(hydroxy)ammonium 3-carboxybenzoate |
title | Diethyl(hydroxy)ammonium 3-carboxybenzoate |
title_full | Diethyl(hydroxy)ammonium 3-carboxybenzoate |
title_fullStr | Diethyl(hydroxy)ammonium 3-carboxybenzoate |
title_full_unstemmed | Diethyl(hydroxy)ammonium 3-carboxybenzoate |
title_short | Diethyl(hydroxy)ammonium 3-carboxybenzoate |
title_sort | diethyl(hydroxy)ammonium 3-carboxybenzoate |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3007967/ https://www.ncbi.nlm.nih.gov/pubmed/21588674 http://dx.doi.org/10.1107/S1600536810030746 |
work_keys_str_mv | AT guoyun diethylhydroxyammonium3carboxybenzoate AT wangcong diethylhydroxyammonium3carboxybenzoate AT chenhaixiang diethylhydroxyammonium3carboxybenzoate |