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Crystal structure of an unknown solvate of bis­(tetra-n-butyl­ammonium) [N,N′-(4-tri­fluoro­methyl-1,2-phenyl­ene)bis­(oxamato)-κ(4) O,N,N′,O′]nickelate(II)

In the title compound, [N(C(4)H(9))(4)](2)[Ni(C(11)H(3)F(3)N(2)O(6))] or [N(n-Bu)(4)](2)[Ni(topbo)] [n-Bu = n-butyl and topbo = 4-tri­fluoro­methyl-1,2-phenyl­enebis(oxamate)], the Ni(2+) cation is coordinated by two deprotonated amido N atoms and two carboxyl­ate O atoms, setting up a slightly dist...

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Autores principales: Eya’ane Meva, François, Schaarschmidt, Dieter, Rüffer, Tobias
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2015
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4459374/
https://www.ncbi.nlm.nih.gov/pubmed/26090126
http://dx.doi.org/10.1107/S205698901500835X
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author Eya’ane Meva, François
Schaarschmidt, Dieter
Rüffer, Tobias
author_facet Eya’ane Meva, François
Schaarschmidt, Dieter
Rüffer, Tobias
author_sort Eya’ane Meva, François
collection PubMed
description In the title compound, [N(C(4)H(9))(4)](2)[Ni(C(11)H(3)F(3)N(2)O(6))] or [N(n-Bu)(4)](2)[Ni(topbo)] [n-Bu = n-butyl and topbo = 4-tri­fluoro­methyl-1,2-phenyl­enebis(oxamate)], the Ni(2+) cation is coordinated by two deprotonated amido N atoms and two carboxyl­ate O atoms, setting up a slightly distorted square-planar coordination environment. The [Ni(topbo](2−) anion lies on a twofold rotation axis. Due to an incompatibility with the point-group symmetry of the complete mol­ecule, orientational disorder of the CF(3) group is observed. The tetra­hedral ammonium cations and the anion are linked by weak inter­molecular C—H⋯O and C—H⋯F hydrogen-bonding inter­actions into a three-dimensional network. A region of electron density was treated with the SQUEEZE procedure in PLATON [Spek (2015). Acta Cryst. C71, 9–18] following unsuccessful attempts to model it as plausible solvent mol­ecule(s). The given chemical formula and other crystal data do not take into account the unknown solvent mol­ecule.
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spelling pubmed-44593742015-06-18 Crystal structure of an unknown solvate of bis­(tetra-n-butyl­ammonium) [N,N′-(4-tri­fluoro­methyl-1,2-phenyl­ene)bis­(oxamato)-κ(4) O,N,N′,O′]nickelate(II) Eya’ane Meva, François Schaarschmidt, Dieter Rüffer, Tobias Acta Crystallogr E Crystallogr Commun Research Communications In the title compound, [N(C(4)H(9))(4)](2)[Ni(C(11)H(3)F(3)N(2)O(6))] or [N(n-Bu)(4)](2)[Ni(topbo)] [n-Bu = n-butyl and topbo = 4-tri­fluoro­methyl-1,2-phenyl­enebis(oxamate)], the Ni(2+) cation is coordinated by two deprotonated amido N atoms and two carboxyl­ate O atoms, setting up a slightly distorted square-planar coordination environment. The [Ni(topbo](2−) anion lies on a twofold rotation axis. Due to an incompatibility with the point-group symmetry of the complete mol­ecule, orientational disorder of the CF(3) group is observed. The tetra­hedral ammonium cations and the anion are linked by weak inter­molecular C—H⋯O and C—H⋯F hydrogen-bonding inter­actions into a three-dimensional network. A region of electron density was treated with the SQUEEZE procedure in PLATON [Spek (2015). Acta Cryst. C71, 9–18] following unsuccessful attempts to model it as plausible solvent mol­ecule(s). The given chemical formula and other crystal data do not take into account the unknown solvent mol­ecule. International Union of Crystallography 2015-05-07 /pmc/articles/PMC4459374/ /pubmed/26090126 http://dx.doi.org/10.1107/S205698901500835X Text en © Eya'ane Meva et al. 2015 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
Eya’ane Meva, François
Schaarschmidt, Dieter
Rüffer, Tobias
Crystal structure of an unknown solvate of bis­(tetra-n-butyl­ammonium) [N,N′-(4-tri­fluoro­methyl-1,2-phenyl­ene)bis­(oxamato)-κ(4) O,N,N′,O′]nickelate(II)
title Crystal structure of an unknown solvate of bis­(tetra-n-butyl­ammonium) [N,N′-(4-tri­fluoro­methyl-1,2-phenyl­ene)bis­(oxamato)-κ(4) O,N,N′,O′]nickelate(II)
title_full Crystal structure of an unknown solvate of bis­(tetra-n-butyl­ammonium) [N,N′-(4-tri­fluoro­methyl-1,2-phenyl­ene)bis­(oxamato)-κ(4) O,N,N′,O′]nickelate(II)
title_fullStr Crystal structure of an unknown solvate of bis­(tetra-n-butyl­ammonium) [N,N′-(4-tri­fluoro­methyl-1,2-phenyl­ene)bis­(oxamato)-κ(4) O,N,N′,O′]nickelate(II)
title_full_unstemmed Crystal structure of an unknown solvate of bis­(tetra-n-butyl­ammonium) [N,N′-(4-tri­fluoro­methyl-1,2-phenyl­ene)bis­(oxamato)-κ(4) O,N,N′,O′]nickelate(II)
title_short Crystal structure of an unknown solvate of bis­(tetra-n-butyl­ammonium) [N,N′-(4-tri­fluoro­methyl-1,2-phenyl­ene)bis­(oxamato)-κ(4) O,N,N′,O′]nickelate(II)
title_sort crystal structure of an unknown solvate of bis­(tetra-n-butyl­ammonium) [n,n′-(4-tri­fluoro­methyl-1,2-phenyl­ene)bis­(oxamato)-κ(4) o,n,n′,o′]nickelate(ii)
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4459374/
https://www.ncbi.nlm.nih.gov/pubmed/26090126
http://dx.doi.org/10.1107/S205698901500835X
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