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Bis[(4-cyano­benz­yl)ammonium] bis­(perchlorate) monohydrate

The asymmetric unit of the title compound, 2C(8)H(9)N(2) (+)·2ClO(4) (−)·H(2)O, consists of two (4-cyano­benz­yl)>ammonium cations, two disordered ClO(4) (−) anions and one water mol­ecule. The differences in the two cations are reflected in the N—C—C—C torsion angles [−94.7 (3) and −115.9 (3)°]....

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Autor principal: Huang, Yao
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3239064/
https://www.ncbi.nlm.nih.gov/pubmed/22199912
http://dx.doi.org/10.1107/S1600536811048884
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author Huang, Yao
author_facet Huang, Yao
author_sort Huang, Yao
collection PubMed
description The asymmetric unit of the title compound, 2C(8)H(9)N(2) (+)·2ClO(4) (−)·H(2)O, consists of two (4-cyano­benz­yl)>ammonium cations, two disordered ClO(4) (−) anions and one water mol­ecule. The differences in the two cations are reflected in the N—C—C—C torsion angles [−94.7 (3) and −115.9 (3)°]. In addition, the cations show different hydrogen-bonding patterns as one N atom bonds to two O atoms of ClO(4) (−) ions, while the other N atom is involved in hydrogen bonding with the O atoms of the ClO(4) (−) ions and water mol­ecules. In the crystal, N—H⋯O and O—H⋯O hydrogen bonds result in a three-dimensional network. An O atom in each of the anions is disordered over two positions of equal occupancy.
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spelling pubmed-32390642011-12-23 Bis[(4-cyano­benz­yl)ammonium] bis­(perchlorate) monohydrate Huang, Yao Acta Crystallogr Sect E Struct Rep Online Organic Papers The asymmetric unit of the title compound, 2C(8)H(9)N(2) (+)·2ClO(4) (−)·H(2)O, consists of two (4-cyano­benz­yl)>ammonium cations, two disordered ClO(4) (−) anions and one water mol­ecule. The differences in the two cations are reflected in the N—C—C—C torsion angles [−94.7 (3) and −115.9 (3)°]. In addition, the cations show different hydrogen-bonding patterns as one N atom bonds to two O atoms of ClO(4) (−) ions, while the other N atom is involved in hydrogen bonding with the O atoms of the ClO(4) (−) ions and water mol­ecules. In the crystal, N—H⋯O and O—H⋯O hydrogen bonds result in a three-dimensional network. An O atom in each of the anions is disordered over two positions of equal occupancy. International Union of Crystallography 2011-11-25 /pmc/articles/PMC3239064/ /pubmed/22199912 http://dx.doi.org/10.1107/S1600536811048884 Text en © Yao Huang 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
Huang, Yao
Bis[(4-cyano­benz­yl)ammonium] bis­(perchlorate) monohydrate
title Bis[(4-cyano­benz­yl)ammonium] bis­(perchlorate) monohydrate
title_full Bis[(4-cyano­benz­yl)ammonium] bis­(perchlorate) monohydrate
title_fullStr Bis[(4-cyano­benz­yl)ammonium] bis­(perchlorate) monohydrate
title_full_unstemmed Bis[(4-cyano­benz­yl)ammonium] bis­(perchlorate) monohydrate
title_short Bis[(4-cyano­benz­yl)ammonium] bis­(perchlorate) monohydrate
title_sort bis[(4-cyano­benz­yl)ammonium] bis­(perchlorate) monohydrate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3239064/
https://www.ncbi.nlm.nih.gov/pubmed/22199912
http://dx.doi.org/10.1107/S1600536811048884
work_keys_str_mv AT huangyao bis4cyanobenzylammoniumbisperchloratemonohydrate