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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...

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Autores principales: Amarante, Tatiana R., Fernandes, José A., Gonçalves, Isabel S., Almeida Paz, Filipe A.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2011
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).
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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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