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2,5-Bis[2-({bis­[3-(dimethyl­aza­nium­yl)prop­yl]aza­nium­yl}meth­yl)phen­yl]-1,3,4-oxadiazole hexa­kis­(perchlorate) sesquihydrate

In the title hydrated salt, C(36)H(66)N(8)O(6+)·6ClO(4) (−)·1.5H(2)O, the asymmetric unit consists of a hexa­protonated [H(6) L](6+) cation, five perchlorate anions in general positions, two on twofold rotation axes (one of which is disordered), and two water mol­ecules of crystallization in general...

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Autores principales: Fusi, Vieri, Formica, Mauro, Macedi, Eleonora, Paoli, Paola, Rossi, Patrizia
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3589030/
https://www.ncbi.nlm.nih.gov/pubmed/23476266
http://dx.doi.org/10.1107/S1600536812047484
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author Fusi, Vieri
Formica, Mauro
Macedi, Eleonora
Paoli, Paola
Rossi, Patrizia
author_facet Fusi, Vieri
Formica, Mauro
Macedi, Eleonora
Paoli, Paola
Rossi, Patrizia
author_sort Fusi, Vieri
collection PubMed
description In the title hydrated salt, C(36)H(66)N(8)O(6+)·6ClO(4) (−)·1.5H(2)O, the asymmetric unit consists of a hexa­protonated [H(6) L](6+) cation, five perchlorate anions in general positions, two on twofold rotation axes (one of which is disordered), and two water mol­ecules of crystallization in general positions, one of them disordered around a twofold crystallographic axis. In the [H(6) L](6+) cation, two strong intra­molecular N—H⋯N hydrogen bonds occur, involving the N atoms of the oxadiazole ring as acceptors and the closest NH(+) groups of each dipropyl­enetriamine unit. In the crystal, the [H(6) L](6+) cations form channels along the a-axis direction, in which the perchlorate counter-ions and the water mol­ecules are lodged. The crystal packing features a network of N—H⋯O and O—H⋯O hydrogen bonds involving the NH(+) groups of the [H(6) L](6+) cation, the perchlorate anions and the water mol­ecules.
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spelling pubmed-35890302013-03-08 2,5-Bis[2-({bis­[3-(dimethyl­aza­nium­yl)prop­yl]aza­nium­yl}meth­yl)phen­yl]-1,3,4-oxadiazole hexa­kis­(perchlorate) sesquihydrate Fusi, Vieri Formica, Mauro Macedi, Eleonora Paoli, Paola Rossi, Patrizia Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title hydrated salt, C(36)H(66)N(8)O(6+)·6ClO(4) (−)·1.5H(2)O, the asymmetric unit consists of a hexa­protonated [H(6) L](6+) cation, five perchlorate anions in general positions, two on twofold rotation axes (one of which is disordered), and two water mol­ecules of crystallization in general positions, one of them disordered around a twofold crystallographic axis. In the [H(6) L](6+) cation, two strong intra­molecular N—H⋯N hydrogen bonds occur, involving the N atoms of the oxadiazole ring as acceptors and the closest NH(+) groups of each dipropyl­enetriamine unit. In the crystal, the [H(6) L](6+) cations form channels along the a-axis direction, in which the perchlorate counter-ions and the water mol­ecules are lodged. The crystal packing features a network of N—H⋯O and O—H⋯O hydrogen bonds involving the NH(+) groups of the [H(6) L](6+) cation, the perchlorate anions and the water mol­ecules. International Union of Crystallography 2012-11-24 /pmc/articles/PMC3589030/ /pubmed/23476266 http://dx.doi.org/10.1107/S1600536812047484 Text en © Fusi 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
Fusi, Vieri
Formica, Mauro
Macedi, Eleonora
Paoli, Paola
Rossi, Patrizia
2,5-Bis[2-({bis­[3-(dimethyl­aza­nium­yl)prop­yl]aza­nium­yl}meth­yl)phen­yl]-1,3,4-oxadiazole hexa­kis­(perchlorate) sesquihydrate
title 2,5-Bis[2-({bis­[3-(dimethyl­aza­nium­yl)prop­yl]aza­nium­yl}meth­yl)phen­yl]-1,3,4-oxadiazole hexa­kis­(perchlorate) sesquihydrate
title_full 2,5-Bis[2-({bis­[3-(dimethyl­aza­nium­yl)prop­yl]aza­nium­yl}meth­yl)phen­yl]-1,3,4-oxadiazole hexa­kis­(perchlorate) sesquihydrate
title_fullStr 2,5-Bis[2-({bis­[3-(dimethyl­aza­nium­yl)prop­yl]aza­nium­yl}meth­yl)phen­yl]-1,3,4-oxadiazole hexa­kis­(perchlorate) sesquihydrate
title_full_unstemmed 2,5-Bis[2-({bis­[3-(dimethyl­aza­nium­yl)prop­yl]aza­nium­yl}meth­yl)phen­yl]-1,3,4-oxadiazole hexa­kis­(perchlorate) sesquihydrate
title_short 2,5-Bis[2-({bis­[3-(dimethyl­aza­nium­yl)prop­yl]aza­nium­yl}meth­yl)phen­yl]-1,3,4-oxadiazole hexa­kis­(perchlorate) sesquihydrate
title_sort 2,5-bis[2-({bis­[3-(dimethyl­aza­nium­yl)prop­yl]aza­nium­yl}meth­yl)phen­yl]-1,3,4-oxadiazole hexa­kis­(perchlorate) sesquihydrate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3589030/
https://www.ncbi.nlm.nih.gov/pubmed/23476266
http://dx.doi.org/10.1107/S1600536812047484
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