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Sulfate-bridged dimeric trinuclear copper(II)–pyrazolate complex with three different terminal ligands

The reaction of CuSO(4)·5H(2)O, 4-chloro­pyrazole (4-Cl-pzH) and tri­ethyl­amine (Et(3)N) in di­methyl­formamide (DMF) produced crystals of di­aqua­hexa­kis­(μ-4-chloro­pyrazolato-κ(2) N:N′)bis­(N,N-di­methyl­formamide)di-μ(3)-hydroxido-bis­(μ(4)-sulfato-κ(4) O:O′:O′′:O′′)hexa­copper(II) N,N-di­meth...

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Autor principal: Mezei, Gellert
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2016
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4971842/
https://www.ncbi.nlm.nih.gov/pubmed/27536383
http://dx.doi.org/10.1107/S2056989016010719
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author Mezei, Gellert
author_facet Mezei, Gellert
author_sort Mezei, Gellert
collection PubMed
description The reaction of CuSO(4)·5H(2)O, 4-chloro­pyrazole (4-Cl-pzH) and tri­ethyl­amine (Et(3)N) in di­methyl­formamide (DMF) produced crystals of di­aqua­hexa­kis­(μ-4-chloro­pyrazolato-κ(2) N:N′)bis­(N,N-di­methyl­formamide)di-μ(3)-hydroxido-bis­(μ(4)-sulfato-κ(4) O:O′:O′′:O′′)hexa­copper(II) N,N-di­methyl­formamide tetra­solvate dihydrate, [Cu(3)(OH)(SO(4))(C(3)H(2)ClN(2))(3)(C(3)H(7)NO)(H(2)O)](2)·4C(3)H(7)NO·2H(2)O. The centrosymmetric dimeric molecule consists of two trinuclear copper–pyrazolate units bridged by two sulfate ions. The title compound provides the first example of a trinuclear copper–pyrazolate complex with three different terminal ligands on the Cu atoms, and also the first example of such complex with a strongly binding basal sulfate ion. Within each trinuclear unit, the Cu(II) atoms are bridged by μ-pyrazolate groups and a central μ(3)-OH group, and are coordinated by terminal sulfate, H(2)O and DMF ligands, respectively. Moreover, the sulfate O atoms coordinate at the apical position to the Cu atoms of the symmetry-related unit, providing square–pyramidal coordination geometry around each copper cation. The metal complex and solvent mol­ecules are involved in O—H⋯O hydrogen bonds, leading to a two-dimensional network parallel to (10-1).
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spelling pubmed-49718422016-08-17 Sulfate-bridged dimeric trinuclear copper(II)–pyrazolate complex with three different terminal ligands Mezei, Gellert Acta Crystallogr E Crystallogr Commun Research Communications The reaction of CuSO(4)·5H(2)O, 4-chloro­pyrazole (4-Cl-pzH) and tri­ethyl­amine (Et(3)N) in di­methyl­formamide (DMF) produced crystals of di­aqua­hexa­kis­(μ-4-chloro­pyrazolato-κ(2) N:N′)bis­(N,N-di­methyl­formamide)di-μ(3)-hydroxido-bis­(μ(4)-sulfato-κ(4) O:O′:O′′:O′′)hexa­copper(II) N,N-di­methyl­formamide tetra­solvate dihydrate, [Cu(3)(OH)(SO(4))(C(3)H(2)ClN(2))(3)(C(3)H(7)NO)(H(2)O)](2)·4C(3)H(7)NO·2H(2)O. The centrosymmetric dimeric molecule consists of two trinuclear copper–pyrazolate units bridged by two sulfate ions. The title compound provides the first example of a trinuclear copper–pyrazolate complex with three different terminal ligands on the Cu atoms, and also the first example of such complex with a strongly binding basal sulfate ion. Within each trinuclear unit, the Cu(II) atoms are bridged by μ-pyrazolate groups and a central μ(3)-OH group, and are coordinated by terminal sulfate, H(2)O and DMF ligands, respectively. Moreover, the sulfate O atoms coordinate at the apical position to the Cu atoms of the symmetry-related unit, providing square–pyramidal coordination geometry around each copper cation. The metal complex and solvent mol­ecules are involved in O—H⋯O hydrogen bonds, leading to a two-dimensional network parallel to (10-1). International Union of Crystallography 2016-07-08 /pmc/articles/PMC4971842/ /pubmed/27536383 http://dx.doi.org/10.1107/S2056989016010719 Text en © Gellert Mezei 2016 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 Research Communications
Mezei, Gellert
Sulfate-bridged dimeric trinuclear copper(II)–pyrazolate complex with three different terminal ligands
title Sulfate-bridged dimeric trinuclear copper(II)–pyrazolate complex with three different terminal ligands
title_full Sulfate-bridged dimeric trinuclear copper(II)–pyrazolate complex with three different terminal ligands
title_fullStr Sulfate-bridged dimeric trinuclear copper(II)–pyrazolate complex with three different terminal ligands
title_full_unstemmed Sulfate-bridged dimeric trinuclear copper(II)–pyrazolate complex with three different terminal ligands
title_short Sulfate-bridged dimeric trinuclear copper(II)–pyrazolate complex with three different terminal ligands
title_sort sulfate-bridged dimeric trinuclear copper(ii)–pyrazolate complex with three different terminal ligands
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4971842/
https://www.ncbi.nlm.nih.gov/pubmed/27536383
http://dx.doi.org/10.1107/S2056989016010719
work_keys_str_mv AT mezeigellert sulfatebridgeddimerictrinuclearcopperiipyrazolatecomplexwiththreedifferentterminalligands