Bis(4-meth­oxy-3,4-di­hydro­quinazolin-1-ium) chloranilate

In the title compound [systematic name: bis­(4-meth­oxy-3,4-di­hydro­quinazolin-1-ium) 2,5-di­chloro-3,6-dioxo­cyclo­hexa-1,4-diene-1,4-diolate], 2C(9)H(11)N(2)O(+)·C(6)Cl(2)O(4) (2−), the chloranil­ate anion lies about an inversion center. The 4-meth­oxy-3,4-di­hydro­quinazolin-1-ium cations are li...

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Detalles Bibliográficos
Autores principales: Gotoh, Kazuma, Ishida, Hiroyuki
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2013
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3884394/
https://www.ncbi.nlm.nih.gov/pubmed/24427103
http://dx.doi.org/10.1107/S1600536813023635
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author Gotoh, Kazuma
Ishida, Hiroyuki
author_facet Gotoh, Kazuma
Ishida, Hiroyuki
author_sort Gotoh, Kazuma
collection PubMed
description In the title compound [systematic name: bis­(4-meth­oxy-3,4-di­hydro­quinazolin-1-ium) 2,5-di­chloro-3,6-dioxo­cyclo­hexa-1,4-diene-1,4-diolate], 2C(9)H(11)N(2)O(+)·C(6)Cl(2)O(4) (2−), the chloranil­ate anion lies about an inversion center. The 4-meth­oxy-3,4-di­hydro­quinazolin-1-ium cations are linked on both sides of the anion via bifurcated N—H⋯(O,O) and weak C—H⋯O hydrogen bonds, giving a centrosymmetric 2:1 aggregate. The 2:1 aggregates are linked by another N—H⋯O hydrogen bond into a tape running along [1-10]. The tapes are further linked by a C—H⋯O hydrogen bond into a layer parallel to the ab plane.
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spelling pubmed-38843942014-01-14 Bis(4-meth­oxy-3,4-di­hydro­quinazolin-1-ium) chloranilate Gotoh, Kazuma Ishida, Hiroyuki Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound [systematic name: bis­(4-meth­oxy-3,4-di­hydro­quinazolin-1-ium) 2,5-di­chloro-3,6-dioxo­cyclo­hexa-1,4-diene-1,4-diolate], 2C(9)H(11)N(2)O(+)·C(6)Cl(2)O(4) (2−), the chloranil­ate anion lies about an inversion center. The 4-meth­oxy-3,4-di­hydro­quinazolin-1-ium cations are linked on both sides of the anion via bifurcated N—H⋯(O,O) and weak C—H⋯O hydrogen bonds, giving a centrosymmetric 2:1 aggregate. The 2:1 aggregates are linked by another N—H⋯O hydrogen bond into a tape running along [1-10]. The tapes are further linked by a C—H⋯O hydrogen bond into a layer parallel to the ab plane. International Union of Crystallography 2013-08-31 /pmc/articles/PMC3884394/ /pubmed/24427103 http://dx.doi.org/10.1107/S1600536813023635 Text en © Gotoh and Ishida 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
Gotoh, Kazuma
Ishida, Hiroyuki
Bis(4-meth­oxy-3,4-di­hydro­quinazolin-1-ium) chloranilate
title Bis(4-meth­oxy-3,4-di­hydro­quinazolin-1-ium) chloranilate
title_full Bis(4-meth­oxy-3,4-di­hydro­quinazolin-1-ium) chloranilate
title_fullStr Bis(4-meth­oxy-3,4-di­hydro­quinazolin-1-ium) chloranilate
title_full_unstemmed Bis(4-meth­oxy-3,4-di­hydro­quinazolin-1-ium) chloranilate
title_short Bis(4-meth­oxy-3,4-di­hydro­quinazolin-1-ium) chloranilate
title_sort bis(4-meth­oxy-3,4-di­hydro­quinazolin-1-ium) chloranilate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3884394/
https://www.ncbi.nlm.nih.gov/pubmed/24427103
http://dx.doi.org/10.1107/S1600536813023635
work_keys_str_mv AT gotohkazuma bis4methoxy34dihydroquinazolin1iumchloranilate
AT ishidahiroyuki bis4methoxy34dihydroquinazolin1iumchloranilate

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