7-(1,3-Dioxolan-2-ylmethyl)-1,3-di­methyl-2,6-dioxo-2,3,6,7-tetra­hydro-1H-purin-9-ium tetra­chloridoferrate(III)

The asymmetric unit of the title compound, (C(11)H(15)N(4)O(4))[FeCl(4)], contains two independent protonated 7-(1,3-dioxolan-2-ylmeth­yl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione (doxofyllinium) and two tetrahedral tetra­chlorido­ferrate(III) anions. In the doxofyllinium, two disordered methyl­...

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Detalles Bibliográficos
Autores principales: Wang, Ping Ping, Gong, Jiang, Ni, Shi-Feng
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2010
Materias:
Metal-Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2983145/
https://www.ncbi.nlm.nih.gov/pubmed/21587397
http://dx.doi.org/10.1107/S1600536810034720
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author Wang, Ping Ping
Gong, Jiang
Ni, Shi-Feng
author_facet Wang, Ping Ping
Gong, Jiang
Ni, Shi-Feng
author_sort Wang, Ping Ping
collection PubMed
description The asymmetric unit of the title compound, (C(11)H(15)N(4)O(4))[FeCl(4)], contains two independent protonated 7-(1,3-dioxolan-2-ylmeth­yl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione (doxofyllinium) and two tetrahedral tetra­chlorido­ferrate(III) anions. In the doxofyllinium, two disordered methyl­ene C atoms are observed in each dioxolane ring with an occupancy ratio of 0.54 (4):0.46 (4). In the crystal, mol­ecules are connected by N—H⋯O hydrogen bonds and weak C—H⋯O and C—H⋯Cl inter­actions.
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spelling pubmed-29831452010-12-30 7-(1,3-Dioxolan-2-ylmethyl)-1,3-di­methyl-2,6-dioxo-2,3,6,7-tetra­hydro-1H-purin-9-ium tetra­chloridoferrate(III) Wang, Ping Ping Gong, Jiang Ni, Shi-Feng Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers The asymmetric unit of the title compound, (C(11)H(15)N(4)O(4))[FeCl(4)], contains two independent protonated 7-(1,3-dioxolan-2-ylmeth­yl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione (doxofyllinium) and two tetrahedral tetra­chlorido­ferrate(III) anions. In the doxofyllinium, two disordered methyl­ene C atoms are observed in each dioxolane ring with an occupancy ratio of 0.54 (4):0.46 (4). In the crystal, mol­ecules are connected by N—H⋯O hydrogen bonds and weak C—H⋯O and C—H⋯Cl inter­actions. International Union of Crystallography 2010-09-11 /pmc/articles/PMC2983145/ /pubmed/21587397 http://dx.doi.org/10.1107/S1600536810034720 Text en © Wang et al. 2010 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 Metal-Organic Papers
Wang, Ping Ping
Gong, Jiang
Ni, Shi-Feng
7-(1,3-Dioxolan-2-ylmethyl)-1,3-di­methyl-2,6-dioxo-2,3,6,7-tetra­hydro-1H-purin-9-ium tetra­chloridoferrate(III)
title 7-(1,3-Dioxolan-2-ylmethyl)-1,3-di­methyl-2,6-dioxo-2,3,6,7-tetra­hydro-1H-purin-9-ium tetra­chloridoferrate(III)
title_full 7-(1,3-Dioxolan-2-ylmethyl)-1,3-di­methyl-2,6-dioxo-2,3,6,7-tetra­hydro-1H-purin-9-ium tetra­chloridoferrate(III)
title_fullStr 7-(1,3-Dioxolan-2-ylmethyl)-1,3-di­methyl-2,6-dioxo-2,3,6,7-tetra­hydro-1H-purin-9-ium tetra­chloridoferrate(III)
title_full_unstemmed 7-(1,3-Dioxolan-2-ylmethyl)-1,3-di­methyl-2,6-dioxo-2,3,6,7-tetra­hydro-1H-purin-9-ium tetra­chloridoferrate(III)
title_short 7-(1,3-Dioxolan-2-ylmethyl)-1,3-di­methyl-2,6-dioxo-2,3,6,7-tetra­hydro-1H-purin-9-ium tetra­chloridoferrate(III)
title_sort 7-(1,3-dioxolan-2-ylmethyl)-1,3-di­methyl-2,6-dioxo-2,3,6,7-tetra­hydro-1h-purin-9-ium tetra­chloridoferrate(iii)
topic Metal-Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2983145/
https://www.ncbi.nlm.nih.gov/pubmed/21587397
http://dx.doi.org/10.1107/S1600536810034720
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AT nishifeng 713dioxolan2ylmethyl13dimethyl26dioxo2367tetrahydro1hpurin9iumtetrachloridoferrateiii

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