4-[(4-Chloro­phen­yl)(phen­yl)­meth­yl]­piperazin-1-ium picrate monohydrate

The asymmetric unit of the title compound, C(17)H(20)ClN(2) (+)·C(6)H(2)N(3)O(7) (−)·H(2)O, contains a piperazin-1-ium cation, a picrate anion and one solvent water mol­ecule. The piperazene ring is protonated at one N atom and adopts a highly distorted chair conformation with the chloro­pheny(phen­...

Descripción completa

Detalles Bibliográficos
Autores principales: Song, Yanxi, Chidan Kumar, C. S., Chandraju, S., Naveen, S., Li, Hongqi
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3414941/
https://www.ncbi.nlm.nih.gov/pubmed/22904928
http://dx.doi.org/10.1107/S1600536812031984
_version_ 1782240284217704448
author Song, Yanxi
Chidan Kumar, C. S.
Chandraju, S.
Naveen, S.
Li, Hongqi
author_facet Song, Yanxi
Chidan Kumar, C. S.
Chandraju, S.
Naveen, S.
Li, Hongqi
author_sort Song, Yanxi
collection PubMed
description The asymmetric unit of the title compound, C(17)H(20)ClN(2) (+)·C(6)H(2)N(3)O(7) (−)·H(2)O, contains a piperazin-1-ium cation, a picrate anion and one solvent water mol­ecule. The piperazene ring is protonated at one N atom and adopts a highly distorted chair conformation with the chloro­pheny(phen­yl)methyl substituent on the second N atom in an equatorial position. The crystal structure is stabilized by O—H⋯O, N—H⋯O and C—H⋯O hydrogen bonds.
format Online
Article
Text
id pubmed-3414941
institution National Center for Biotechnology Information
language English
publishDate 2012
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-34149412012-08-17 4-[(4-Chloro­phen­yl)(phen­yl)­meth­yl]­piperazin-1-ium picrate monohydrate Song, Yanxi Chidan Kumar, C. S. Chandraju, S. Naveen, S. Li, Hongqi Acta Crystallogr Sect E Struct Rep Online Organic Papers The asymmetric unit of the title compound, C(17)H(20)ClN(2) (+)·C(6)H(2)N(3)O(7) (−)·H(2)O, contains a piperazin-1-ium cation, a picrate anion and one solvent water mol­ecule. The piperazene ring is protonated at one N atom and adopts a highly distorted chair conformation with the chloro­pheny(phen­yl)methyl substituent on the second N atom in an equatorial position. The crystal structure is stabilized by O—H⋯O, N—H⋯O and C—H⋯O hydrogen bonds. International Union of Crystallography 2012-07-18 /pmc/articles/PMC3414941/ /pubmed/22904928 http://dx.doi.org/10.1107/S1600536812031984 Text en © Song 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
Song, Yanxi
Chidan Kumar, C. S.
Chandraju, S.
Naveen, S.
Li, Hongqi
4-[(4-Chloro­phen­yl)(phen­yl)­meth­yl]­piperazin-1-ium picrate monohydrate
title 4-[(4-Chloro­phen­yl)(phen­yl)­meth­yl]­piperazin-1-ium picrate monohydrate
title_full 4-[(4-Chloro­phen­yl)(phen­yl)­meth­yl]­piperazin-1-ium picrate monohydrate
title_fullStr 4-[(4-Chloro­phen­yl)(phen­yl)­meth­yl]­piperazin-1-ium picrate monohydrate
title_full_unstemmed 4-[(4-Chloro­phen­yl)(phen­yl)­meth­yl]­piperazin-1-ium picrate monohydrate
title_short 4-[(4-Chloro­phen­yl)(phen­yl)­meth­yl]­piperazin-1-ium picrate monohydrate
title_sort 4-[(4-chloro­phen­yl)(phen­yl)­meth­yl]­piperazin-1-ium picrate monohydrate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3414941/
https://www.ncbi.nlm.nih.gov/pubmed/22904928
http://dx.doi.org/10.1107/S1600536812031984
work_keys_str_mv AT songyanxi 44chlorophenylphenylmethylpiperazin1iumpicratemonohydrate
AT chidankumarcs 44chlorophenylphenylmethylpiperazin1iumpicratemonohydrate
AT chandrajus 44chlorophenylphenylmethylpiperazin1iumpicratemonohydrate
AT naveens 44chlorophenylphenylmethylpiperazin1iumpicratemonohydrate
AT lihongqi 44chlorophenylphenylmethylpiperazin1iumpicratemonohydrate

Ejemplares similares