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Crystal structure of bis{μ(2)-[(2-iminocyclopentylidene)methylidene]azanido-κ(2) N:N′}bis[(η(5)-pentamethylcyclopentadienyl)zirconium(IV)] hexane monosolvate
The title compound, [Zr(2)(C(10)H(15))(4)(C(6)H(6)N(2))(2)]·C(6)H(14), was obtained by the stoichiometric reaction of adiponitrile with [Zr(C(10)H(15))(2)(η(2)-Me(3)SiC(2)SiMe(3))]. Intramolecular nitrile–nitrile couplings and deprotonation of the substrate produced the (1-imino-2-enimino)cyclop...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
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International Union of Crystallography
2015
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4719842/ https://www.ncbi.nlm.nih.gov/pubmed/26870433 http://dx.doi.org/10.1107/S2056989015021234 |
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author | Becker, Lisanne Spannenberg, Anke Arndt, Perdita Rosenthal, Uwe |
author_facet | Becker, Lisanne Spannenberg, Anke Arndt, Perdita Rosenthal, Uwe |
author_sort | Becker, Lisanne |
collection | PubMed |
description | The title compound, [Zr(2)(C(10)H(15))(4)(C(6)H(6)N(2))(2)]·C(6)H(14), was obtained by the stoichiometric reaction of adiponitrile with [Zr(C(10)H(15))(2)(η(2)-Me(3)SiC(2)SiMe(3))]. Intramolecular nitrile–nitrile couplings and deprotonation of the substrate produced the (1-imino-2-enimino)cyclopentane ligand, which functions as a five-membered bridge between the two metal atoms. The Zr(IV) atom exhibits a distorted tetrahedral coordination sphere defined by two pentamethylcyclopentadienyl ligands, by the imino unit of one (1-imino-2-enimino)cyclopentane and by the enimino unit of the second (1-imino-2-enimino)cyclopentane. The cyclopentane ring of the ligand shows an envelope conformation. The asymmetric unit contains one half of the complex and one half of the hexane solvent molecule, both being completed by the application of inversion symmetry. One of the pentamethylcyclopentadienyl ligands is disordered over two sets of sites with a refined occupancy ratio of 0.8111 (3):0.189 (3). In the crystal, the complex molecules are packed into rods extending along [100], with the solvent molecules located in between. The rods are arranged in a distorted hexagonal packing. |
format | Online Article Text |
id | pubmed-4719842 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2015 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-47198422016-02-11 Crystal structure of bis{μ(2)-[(2-iminocyclopentylidene)methylidene]azanido-κ(2) N:N′}bis[(η(5)-pentamethylcyclopentadienyl)zirconium(IV)] hexane monosolvate Becker, Lisanne Spannenberg, Anke Arndt, Perdita Rosenthal, Uwe Acta Crystallogr E Crystallogr Commun Data Reports The title compound, [Zr(2)(C(10)H(15))(4)(C(6)H(6)N(2))(2)]·C(6)H(14), was obtained by the stoichiometric reaction of adiponitrile with [Zr(C(10)H(15))(2)(η(2)-Me(3)SiC(2)SiMe(3))]. Intramolecular nitrile–nitrile couplings and deprotonation of the substrate produced the (1-imino-2-enimino)cyclopentane ligand, which functions as a five-membered bridge between the two metal atoms. The Zr(IV) atom exhibits a distorted tetrahedral coordination sphere defined by two pentamethylcyclopentadienyl ligands, by the imino unit of one (1-imino-2-enimino)cyclopentane and by the enimino unit of the second (1-imino-2-enimino)cyclopentane. The cyclopentane ring of the ligand shows an envelope conformation. The asymmetric unit contains one half of the complex and one half of the hexane solvent molecule, both being completed by the application of inversion symmetry. One of the pentamethylcyclopentadienyl ligands is disordered over two sets of sites with a refined occupancy ratio of 0.8111 (3):0.189 (3). In the crystal, the complex molecules are packed into rods extending along [100], with the solvent molecules located in between. The rods are arranged in a distorted hexagonal packing. International Union of Crystallography 2015-11-14 /pmc/articles/PMC4719842/ /pubmed/26870433 http://dx.doi.org/10.1107/S2056989015021234 Text en © Becker 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 | Data Reports Becker, Lisanne Spannenberg, Anke Arndt, Perdita Rosenthal, Uwe Crystal structure of bis{μ(2)-[(2-iminocyclopentylidene)methylidene]azanido-κ(2) N:N′}bis[(η(5)-pentamethylcyclopentadienyl)zirconium(IV)] hexane monosolvate |
title | Crystal structure of bis{μ(2)-[(2-iminocyclopentylidene)methylidene]azanido-κ(2)
N:N′}bis[(η(5)-pentamethylcyclopentadienyl)zirconium(IV)] hexane monosolvate |
title_full | Crystal structure of bis{μ(2)-[(2-iminocyclopentylidene)methylidene]azanido-κ(2)
N:N′}bis[(η(5)-pentamethylcyclopentadienyl)zirconium(IV)] hexane monosolvate |
title_fullStr | Crystal structure of bis{μ(2)-[(2-iminocyclopentylidene)methylidene]azanido-κ(2)
N:N′}bis[(η(5)-pentamethylcyclopentadienyl)zirconium(IV)] hexane monosolvate |
title_full_unstemmed | Crystal structure of bis{μ(2)-[(2-iminocyclopentylidene)methylidene]azanido-κ(2)
N:N′}bis[(η(5)-pentamethylcyclopentadienyl)zirconium(IV)] hexane monosolvate |
title_short | Crystal structure of bis{μ(2)-[(2-iminocyclopentylidene)methylidene]azanido-κ(2)
N:N′}bis[(η(5)-pentamethylcyclopentadienyl)zirconium(IV)] hexane monosolvate |
title_sort | crystal structure of bis{μ(2)-[(2-iminocyclopentylidene)methylidene]azanido-κ(2)
n:n′}bis[(η(5)-pentamethylcyclopentadienyl)zirconium(iv)] hexane monosolvate |
topic | Data Reports |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4719842/ https://www.ncbi.nlm.nih.gov/pubmed/26870433 http://dx.doi.org/10.1107/S2056989015021234 |
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