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Tetra-μ(3)-iodido-tetra­kis­[(tri-n-butyl­phosphane-κP)copper(I)]

The title complex, [Cu(4)I(4)(C(12)H(27)P)(4)], crystallizes with six mol­ecules in the unit cell and with three independent one-third mol­ecule fragments, completed by application of the relevant symmetry operators, in the asymmetric unit. The tetranuclear copper core shows a tetrahedral geometry (...

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Autores principales: Klenk, Simon, Frey, Wolfgang, Bubrin, Martina, Laschat, Sabine
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2014
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3998569/
https://www.ncbi.nlm.nih.gov/pubmed/24826086
http://dx.doi.org/10.1107/S1600536814003390
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author Klenk, Simon
Frey, Wolfgang
Bubrin, Martina
Laschat, Sabine
author_facet Klenk, Simon
Frey, Wolfgang
Bubrin, Martina
Laschat, Sabine
author_sort Klenk, Simon
collection PubMed
description The title complex, [Cu(4)I(4)(C(12)H(27)P)(4)], crystallizes with six mol­ecules in the unit cell and with three independent one-third mol­ecule fragments, completed by application of the relevant symmetry operators, in the asymmetric unit. The tetranuclear copper core shows a tetrahedral geometry (site symmetry 3..). The I atoms also form a tetra­hedron, with I⋯I distances of 4.471 (1) Å. Both tetra­hedra show an orientation similar to that of a pair of self-dual platonic bodies. The edges of the I-tetra­hedral structure are capped to the face centers of the Cu-tetra­hedron and vice versa. The Cu(face)⋯I distances are 2.18 Å (averaged) and the I(face)⋯Cu distances are 0.78 Å (averaged). As a geometric consequence of these properties there are eight distorted trigonal–bipyramidal polyhedra evident, wherein each trigonal face builds up the equatorial site and the opposite Cu⋯I positions form the axial site. As expected, the n-butyl moieties are highly flexible, resulting in large elongations of their anisotropic displacement parameters. Some C atoms of the n-butyl groups were needed to fix alternative discrete disordered positions.
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spelling pubmed-39985692014-05-13 Tetra-μ(3)-iodido-tetra­kis­[(tri-n-butyl­phosphane-κP)copper(I)] Klenk, Simon Frey, Wolfgang Bubrin, Martina Laschat, Sabine Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers The title complex, [Cu(4)I(4)(C(12)H(27)P)(4)], crystallizes with six mol­ecules in the unit cell and with three independent one-third mol­ecule fragments, completed by application of the relevant symmetry operators, in the asymmetric unit. The tetranuclear copper core shows a tetrahedral geometry (site symmetry 3..). The I atoms also form a tetra­hedron, with I⋯I distances of 4.471 (1) Å. Both tetra­hedra show an orientation similar to that of a pair of self-dual platonic bodies. The edges of the I-tetra­hedral structure are capped to the face centers of the Cu-tetra­hedron and vice versa. The Cu(face)⋯I distances are 2.18 Å (averaged) and the I(face)⋯Cu distances are 0.78 Å (averaged). As a geometric consequence of these properties there are eight distorted trigonal–bipyramidal polyhedra evident, wherein each trigonal face builds up the equatorial site and the opposite Cu⋯I positions form the axial site. As expected, the n-butyl moieties are highly flexible, resulting in large elongations of their anisotropic displacement parameters. Some C atoms of the n-butyl groups were needed to fix alternative discrete disordered positions. International Union of Crystallography 2014-03-05 /pmc/articles/PMC3998569/ /pubmed/24826086 http://dx.doi.org/10.1107/S1600536814003390 Text en © Klenk et al. 2014 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
Klenk, Simon
Frey, Wolfgang
Bubrin, Martina
Laschat, Sabine
Tetra-μ(3)-iodido-tetra­kis­[(tri-n-butyl­phosphane-κP)copper(I)]
title Tetra-μ(3)-iodido-tetra­kis­[(tri-n-butyl­phosphane-κP)copper(I)]
title_full Tetra-μ(3)-iodido-tetra­kis­[(tri-n-butyl­phosphane-κP)copper(I)]
title_fullStr Tetra-μ(3)-iodido-tetra­kis­[(tri-n-butyl­phosphane-κP)copper(I)]
title_full_unstemmed Tetra-μ(3)-iodido-tetra­kis­[(tri-n-butyl­phosphane-κP)copper(I)]
title_short Tetra-μ(3)-iodido-tetra­kis­[(tri-n-butyl­phosphane-κP)copper(I)]
title_sort tetra-μ(3)-iodido-tetra­kis­[(tri-n-butyl­phosphane-κp)copper(i)]
topic Metal-Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3998569/
https://www.ncbi.nlm.nih.gov/pubmed/24826086
http://dx.doi.org/10.1107/S1600536814003390
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