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Tris(4,4′-di-tert-butyl-2,2′-bipyridine-κ(2) N,N′)molybdenum(II) μ(6)-oxido-dodeca-μ(2)-oxido-hexaoxidohexamolybdate(VI) acetonitrile tetrasolvate
The asymmetric unit of the title compound, [Mo(C(18)H(24)N(2))(3)][Mo(6)O(19)]·4CH(3)CN, comprises an [Mo(di-t-Bu-bipy)(3)](2+) cation (di-t-Bu-bipy is 4,4′-di-tert-butyl-2,2′-bipyridine), two halves of Lindqvist-type [Mo(6)O(19)](2−) anions (with each anion completed by the application of a center...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2011
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3238728/ https://www.ncbi.nlm.nih.gov/pubmed/22199605 http://dx.doi.org/10.1107/S1600536811049385 |
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author | Amarante, Tatiana R. Fernandes, José A. Gonçalves, Isabel S. Almeida Paz, Filipe A. |
author_facet | Amarante, Tatiana R. Fernandes, José A. Gonçalves, Isabel S. Almeida Paz, Filipe A. |
author_sort | Amarante, Tatiana R. |
collection | PubMed |
description | The asymmetric unit of the title compound, [Mo(C(18)H(24)N(2))(3)][Mo(6)O(19)]·4CH(3)CN, comprises an [Mo(di-t-Bu-bipy)(3)](2+) cation (di-t-Bu-bipy is 4,4′-di-tert-butyl-2,2′-bipyridine), two halves of Lindqvist-type [Mo(6)O(19)](2−) anions (with each anion completed by the application of a center of inversion) and four acetonitrile solvent molecules. The geometry around the metal atom of the cation resembles a distorted octahedron, with each of the three di-t-Bu-bipy ligands being almost planar [deviation from planarity < 6.3 (2)°]. Supramolecular interactions, namely Mo=O⋯π, C N⋯π, C—H⋯O and C—H⋯N, along with electrostatic forces, mediate the crystal packing. Two of the tert-butyl groups are affected by rotational disorder which was modeled over two distinct positions with major site occupancies of 0.707 (9) and 0.769 (8). |
format | Online Article Text |
id | pubmed-3238728 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2011 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-32387282011-12-23 Tris(4,4′-di-tert-butyl-2,2′-bipyridine-κ(2) N,N′)molybdenum(II) μ(6)-oxido-dodeca-μ(2)-oxido-hexaoxidohexamolybdate(VI) acetonitrile tetrasolvate Amarante, Tatiana R. Fernandes, José A. Gonçalves, Isabel S. Almeida Paz, Filipe A. Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers The asymmetric unit of the title compound, [Mo(C(18)H(24)N(2))(3)][Mo(6)O(19)]·4CH(3)CN, comprises an [Mo(di-t-Bu-bipy)(3)](2+) cation (di-t-Bu-bipy is 4,4′-di-tert-butyl-2,2′-bipyridine), two halves of Lindqvist-type [Mo(6)O(19)](2−) anions (with each anion completed by the application of a center of inversion) and four acetonitrile solvent molecules. The geometry around the metal atom of the cation resembles a distorted octahedron, with each of the three di-t-Bu-bipy ligands being almost planar [deviation from planarity < 6.3 (2)°]. Supramolecular interactions, namely Mo=O⋯π, C N⋯π, C—H⋯O and C—H⋯N, along with electrostatic forces, mediate the crystal packing. Two of the tert-butyl groups are affected by rotational disorder which was modeled over two distinct positions with major site occupancies of 0.707 (9) and 0.769 (8). International Union of Crystallography 2011-11-25 /pmc/articles/PMC3238728/ /pubmed/22199605 http://dx.doi.org/10.1107/S1600536811049385 Text en © Amarante et al. 2011 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 Amarante, Tatiana R. Fernandes, José A. Gonçalves, Isabel S. Almeida Paz, Filipe A. Tris(4,4′-di-tert-butyl-2,2′-bipyridine-κ(2) N,N′)molybdenum(II) μ(6)-oxido-dodeca-μ(2)-oxido-hexaoxidohexamolybdate(VI) acetonitrile tetrasolvate |
title | Tris(4,4′-di-tert-butyl-2,2′-bipyridine-κ(2)
N,N′)molybdenum(II) μ(6)-oxido-dodeca-μ(2)-oxido-hexaoxidohexamolybdate(VI) acetonitrile tetrasolvate |
title_full | Tris(4,4′-di-tert-butyl-2,2′-bipyridine-κ(2)
N,N′)molybdenum(II) μ(6)-oxido-dodeca-μ(2)-oxido-hexaoxidohexamolybdate(VI) acetonitrile tetrasolvate |
title_fullStr | Tris(4,4′-di-tert-butyl-2,2′-bipyridine-κ(2)
N,N′)molybdenum(II) μ(6)-oxido-dodeca-μ(2)-oxido-hexaoxidohexamolybdate(VI) acetonitrile tetrasolvate |
title_full_unstemmed | Tris(4,4′-di-tert-butyl-2,2′-bipyridine-κ(2)
N,N′)molybdenum(II) μ(6)-oxido-dodeca-μ(2)-oxido-hexaoxidohexamolybdate(VI) acetonitrile tetrasolvate |
title_short | Tris(4,4′-di-tert-butyl-2,2′-bipyridine-κ(2)
N,N′)molybdenum(II) μ(6)-oxido-dodeca-μ(2)-oxido-hexaoxidohexamolybdate(VI) acetonitrile tetrasolvate |
title_sort | tris(4,4′-di-tert-butyl-2,2′-bipyridine-κ(2)
n,n′)molybdenum(ii) μ(6)-oxido-dodeca-μ(2)-oxido-hexaoxidohexamolybdate(vi) acetonitrile tetrasolvate |
topic | Metal-Organic Papers |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3238728/ https://www.ncbi.nlm.nih.gov/pubmed/22199605 http://dx.doi.org/10.1107/S1600536811049385 |
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