2H-[1,3]Thiazolo[5,4,3-ij]quinolin-3-ium chloride monohydrate

The structure of the title hydrated molecular salt, C10H8NS+·Cl−·H2O, obtained by the reaction of sodium quinoline-8-thiolate Na(Quin-8-S) with CH2Cl2 and an aqueous solution of [Bu4N]Cl, contains π-stacked cations [plane-to-plane separation = 3.338 (4)–3.356 (4) Å] and features chains built by alte...

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Main Authors:	Madeleine A. Ehweiner, Ferdinand Belaj, Nadia C. Mösch-Zanetti
Format:	Article
Language:	English
Published:	International Union of Crystallography 2020-11-01
Series:	IUCrData
Subjects:	crystal structure quinoline hydrogen bonding
Online Access:	http://scripts.iucr.org/cgi-bin/paper?S2414314620014650

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spelling	doaj-4f2378a328c643cfb7e123c4c01abb642021-04-22T09:45:09ZengInternational Union of CrystallographyIUCrData2414-31462020-11-01511x20146510.1107/S2414314620014650hb43682H-[1,3]Thiazolo[5,4,3-ij]quinolin-3-ium chloride monohydrateMadeleine A. Ehweiner0Ferdinand Belaj1Nadia C. Mösch-Zanetti2University of Graz, Institute of Chemistry, Schubertstr. 1, 8010 Graz, AustriaUniversity of Graz, Institute of Chemistry, Schubertstr. 1, 8010 Graz, AustriaUniversity of Graz, Institute of Chemistry, Schubertstr. 1, 8010 Graz, AustriaThe structure of the title hydrated molecular salt, C10H8NS+·Cl−·H2O, obtained by the reaction of sodium quinoline-8-thiolate Na(Quin-8-S) with CH2Cl2 and an aqueous solution of [Bu4N]Cl, contains π-stacked cations [plane-to-plane separation = 3.338 (4)–3.356 (4) Å] and features chains built by alternating Cl− anions and H2O molecules connected by O—H...O hydrogen bonds. The cation shows whole-molecule disorder over two flipped orientations in a 0.853 (3):0.147 (3) ratio.http://scripts.iucr.org/cgi-bin/paper?S2414314620014650crystal structurequinolinehydrogen bonding
collection	DOAJ
language	English
format	Article
sources	DOAJ
author	Madeleine A. Ehweiner Ferdinand Belaj Nadia C. Mösch-Zanetti
spellingShingle	Madeleine A. Ehweiner Ferdinand Belaj Nadia C. Mösch-Zanetti 2H-[1,3]Thiazolo[5,4,3-ij]quinolin-3-ium chloride monohydrate IUCrData crystal structure quinoline hydrogen bonding
author_facet	Madeleine A. Ehweiner Ferdinand Belaj Nadia C. Mösch-Zanetti
author_sort	Madeleine A. Ehweiner
title	2H-[1,3]Thiazolo[5,4,3-ij]quinolin-3-ium chloride monohydrate
title_short	2H-[1,3]Thiazolo[5,4,3-ij]quinolin-3-ium chloride monohydrate
title_full	2H-[1,3]Thiazolo[5,4,3-ij]quinolin-3-ium chloride monohydrate
title_fullStr	2H-[1,3]Thiazolo[5,4,3-ij]quinolin-3-ium chloride monohydrate
title_full_unstemmed	2H-[1,3]Thiazolo[5,4,3-ij]quinolin-3-ium chloride monohydrate
title_sort	2h-[1,3]thiazolo[5,4,3-ij]quinolin-3-ium chloride monohydrate
publisher	International Union of Crystallography
series	IUCrData
issn	2414-3146
publishDate	2020-11-01
description	The structure of the title hydrated molecular salt, C10H8NS+·Cl−·H2O, obtained by the reaction of sodium quinoline-8-thiolate Na(Quin-8-S) with CH2Cl2 and an aqueous solution of [Bu4N]Cl, contains π-stacked cations [plane-to-plane separation = 3.338 (4)–3.356 (4) Å] and features chains built by alternating Cl− anions and H2O molecules connected by O—H...O hydrogen bonds. The cation shows whole-molecule disorder over two flipped orientations in a 0.853 (3):0.147 (3) ratio.
topic	crystal structure quinoline hydrogen bonding
url	http://scripts.iucr.org/cgi-bin/paper?S2414314620014650
work_keys_str_mv	AT madeleineaehweiner 2h13thiazolo543ijquinolin3iumchloridemonohydrate AT ferdinandbelaj 2h13thiazolo543ijquinolin3iumchloridemonohydrate AT nadiacmoschzanetti 2h13thiazolo543ijquinolin3iumchloridemonohydrate
_version_	1721514663134363648

2H-[1,3]Thiazolo[5,4,3-ij]quinolin-3-ium chloride monohydrate

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