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4-[Bis(4-fluoro­phen­yl)meth­yl]-1-[(2E)-3-phenyl­prop-2-en-1-yl]piperazin-1-ium 3-carb­oxy­propano­ate

In the title salt, C(26)H(27)F(2)N(2) (+)·C(4)H(5)O(4) (−), the piperazine N atom bearing the vinylic substituent is protonated. The piperazine ring adopts a chair conformation. In ther crystal, the succinate monoanions are connected via short O—H⋯O hydrogen bonds between the carb­oxy­lic acid and c...

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Autores principales: Kavitha, Channappa N., Yathirajan, Hemmige S., Narayana, Badiadka, Gerber, Thomas, van Brecht, Benjamin, Betz, Richard
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2013
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3569791/
https://www.ncbi.nlm.nih.gov/pubmed/23424537
http://dx.doi.org/10.1107/S1600536813000706
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author Kavitha, Channappa N.
Yathirajan, Hemmige S.
Narayana, Badiadka
Gerber, Thomas
van Brecht, Benjamin
Betz, Richard
author_facet Kavitha, Channappa N.
Yathirajan, Hemmige S.
Narayana, Badiadka
Gerber, Thomas
van Brecht, Benjamin
Betz, Richard
author_sort Kavitha, Channappa N.
collection PubMed
description In the title salt, C(26)H(27)F(2)N(2) (+)·C(4)H(5)O(4) (−), the piperazine N atom bearing the vinylic substituent is protonated. The piperazine ring adopts a chair conformation. In ther crystal, the succinate monoanions are connected via short O—H⋯O hydrogen bonds between the carb­oxy­lic acid and carboxyl­ate groups into undulating chains extending along [001] and the flunarizinium monocations are attached to these chains via N(+)—H⋯O(−) hydrogen bonds. C—H⋯O inter­actions connect these chains into a three-dimensional network. The shortest centroid–centroid distance of 3.7256 (10) Å was found between one of the fluorinated benzene rings and the non-fluorinated phenyl ring in the neighbouring mol­ecule related by a glide plane.
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spelling pubmed-35697912013-02-19 4-[Bis(4-fluoro­phen­yl)meth­yl]-1-[(2E)-3-phenyl­prop-2-en-1-yl]piperazin-1-ium 3-carb­oxy­propano­ate Kavitha, Channappa N. Yathirajan, Hemmige S. Narayana, Badiadka Gerber, Thomas van Brecht, Benjamin Betz, Richard Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title salt, C(26)H(27)F(2)N(2) (+)·C(4)H(5)O(4) (−), the piperazine N atom bearing the vinylic substituent is protonated. The piperazine ring adopts a chair conformation. In ther crystal, the succinate monoanions are connected via short O—H⋯O hydrogen bonds between the carb­oxy­lic acid and carboxyl­ate groups into undulating chains extending along [001] and the flunarizinium monocations are attached to these chains via N(+)—H⋯O(−) hydrogen bonds. C—H⋯O inter­actions connect these chains into a three-dimensional network. The shortest centroid–centroid distance of 3.7256 (10) Å was found between one of the fluorinated benzene rings and the non-fluorinated phenyl ring in the neighbouring mol­ecule related by a glide plane. International Union of Crystallography 2013-01-19 /pmc/articles/PMC3569791/ /pubmed/23424537 http://dx.doi.org/10.1107/S1600536813000706 Text en © Kavitha et al. 2013 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
Kavitha, Channappa N.
Yathirajan, Hemmige S.
Narayana, Badiadka
Gerber, Thomas
van Brecht, Benjamin
Betz, Richard
4-[Bis(4-fluoro­phen­yl)meth­yl]-1-[(2E)-3-phenyl­prop-2-en-1-yl]piperazin-1-ium 3-carb­oxy­propano­ate
title 4-[Bis(4-fluoro­phen­yl)meth­yl]-1-[(2E)-3-phenyl­prop-2-en-1-yl]piperazin-1-ium 3-carb­oxy­propano­ate
title_full 4-[Bis(4-fluoro­phen­yl)meth­yl]-1-[(2E)-3-phenyl­prop-2-en-1-yl]piperazin-1-ium 3-carb­oxy­propano­ate
title_fullStr 4-[Bis(4-fluoro­phen­yl)meth­yl]-1-[(2E)-3-phenyl­prop-2-en-1-yl]piperazin-1-ium 3-carb­oxy­propano­ate
title_full_unstemmed 4-[Bis(4-fluoro­phen­yl)meth­yl]-1-[(2E)-3-phenyl­prop-2-en-1-yl]piperazin-1-ium 3-carb­oxy­propano­ate
title_short 4-[Bis(4-fluoro­phen­yl)meth­yl]-1-[(2E)-3-phenyl­prop-2-en-1-yl]piperazin-1-ium 3-carb­oxy­propano­ate
title_sort 4-[bis(4-fluoro­phen­yl)meth­yl]-1-[(2e)-3-phenyl­prop-2-en-1-yl]piperazin-1-ium 3-carb­oxy­propano­ate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3569791/
https://www.ncbi.nlm.nih.gov/pubmed/23424537
http://dx.doi.org/10.1107/S1600536813000706
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