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Bis(2-{2-[2-(benzylcarbamoyl)phenoxy]acetamido}ethyl)ammonium nitrate ethanol disolvate
In the title compound, C(36)H(40)N(5)O(6) (+)·NO(3) (−)·2C(2)H(5)OH, the nitrate anion is disordered over the two orientations of equal occupancy while the solvent molecule reveals large displacement parameters. The cation is formed by protonation of the N atom of a secondary amine in the middle of...
Autores principales: | , , , , |
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Formato: | Texto |
Lenguaje: | English |
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International Union of Crystallography
2010
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3050242/ https://www.ncbi.nlm.nih.gov/pubmed/21522705 http://dx.doi.org/10.1107/S1600536810052670 |
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author | Liu, Jiaji Tang, Xiaoliang Lu, Zhengdan Zhang, Guolin Liu, Weisheng |
author_facet | Liu, Jiaji Tang, Xiaoliang Lu, Zhengdan Zhang, Guolin Liu, Weisheng |
author_sort | Liu, Jiaji |
collection | PubMed |
description | In the title compound, C(36)H(40)N(5)O(6) (+)·NO(3) (−)·2C(2)H(5)OH, the nitrate anion is disordered over the two orientations of equal occupancy while the solvent molecule reveals large displacement parameters. The cation is formed by protonation of the N atom of a secondary amine in the middle of the flexible chain and the whole compound has crystallographically imposed C-2 symmetry with the crystallographic b axis. An O atom of the nitrate anion links the acidic H atoms of the cation via N—H⋯O hydrogen bonding. In addition, neighbouring cations are connected by intermolecular N—H⋯O hydrogen bonds and π–π interactions between the benzamide groups of the cations [centroid–centroid distance = 4.000 (3) Å], forming a chain along [001]. The ethanol solvent molecules are arranged on the side of the chain through O—H⋯O hydrogen bonds. |
format | Text |
id | pubmed-3050242 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2010 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-30502422011-04-26 Bis(2-{2-[2-(benzylcarbamoyl)phenoxy]acetamido}ethyl)ammonium nitrate ethanol disolvate Liu, Jiaji Tang, Xiaoliang Lu, Zhengdan Zhang, Guolin Liu, Weisheng Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, C(36)H(40)N(5)O(6) (+)·NO(3) (−)·2C(2)H(5)OH, the nitrate anion is disordered over the two orientations of equal occupancy while the solvent molecule reveals large displacement parameters. The cation is formed by protonation of the N atom of a secondary amine in the middle of the flexible chain and the whole compound has crystallographically imposed C-2 symmetry with the crystallographic b axis. An O atom of the nitrate anion links the acidic H atoms of the cation via N—H⋯O hydrogen bonding. In addition, neighbouring cations are connected by intermolecular N—H⋯O hydrogen bonds and π–π interactions between the benzamide groups of the cations [centroid–centroid distance = 4.000 (3) Å], forming a chain along [001]. The ethanol solvent molecules are arranged on the side of the chain through O—H⋯O hydrogen bonds. International Union of Crystallography 2010-12-24 /pmc/articles/PMC3050242/ /pubmed/21522705 http://dx.doi.org/10.1107/S1600536810052670 Text en © Liu 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. |
spellingShingle | Organic Papers Liu, Jiaji Tang, Xiaoliang Lu, Zhengdan Zhang, Guolin Liu, Weisheng Bis(2-{2-[2-(benzylcarbamoyl)phenoxy]acetamido}ethyl)ammonium nitrate ethanol disolvate |
title | Bis(2-{2-[2-(benzylcarbamoyl)phenoxy]acetamido}ethyl)ammonium nitrate ethanol disolvate |
title_full | Bis(2-{2-[2-(benzylcarbamoyl)phenoxy]acetamido}ethyl)ammonium nitrate ethanol disolvate |
title_fullStr | Bis(2-{2-[2-(benzylcarbamoyl)phenoxy]acetamido}ethyl)ammonium nitrate ethanol disolvate |
title_full_unstemmed | Bis(2-{2-[2-(benzylcarbamoyl)phenoxy]acetamido}ethyl)ammonium nitrate ethanol disolvate |
title_short | Bis(2-{2-[2-(benzylcarbamoyl)phenoxy]acetamido}ethyl)ammonium nitrate ethanol disolvate |
title_sort | bis(2-{2-[2-(benzylcarbamoyl)phenoxy]acetamido}ethyl)ammonium nitrate ethanol disolvate |
topic | Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3050242/ https://www.ncbi.nlm.nih.gov/pubmed/21522705 http://dx.doi.org/10.1107/S1600536810052670 |
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