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Redetermination of the crystal structure of dimethylbis[2,4-pentanedionato(1−)-κ(2) O (2),O (4)]tin(IV)
The redetermination of the title compound, [Sn(CH(3))(2)(C(5)H(7)O(2))(2)] or SnMe(2)(acac)(2), from CCD data recorded at 100 K basically confirms the previous study based on integrated film data recorded at room temperature [Miller & Schlemper (1972 ▸). Inorg. Chem. 12, 677–681], but reveals a...
Autores principales: | , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
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International Union of Crystallography
2017
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5382601/ https://www.ncbi.nlm.nih.gov/pubmed/28435700 http://dx.doi.org/10.1107/S2056989017003206 |
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author | Reuter, Hans Reichelt, Martin |
author_facet | Reuter, Hans Reichelt, Martin |
author_sort | Reuter, Hans |
collection | PubMed |
description | The redetermination of the title compound, [Sn(CH(3))(2)(C(5)H(7)O(2))(2)] or SnMe(2)(acac)(2), from CCD data recorded at 100 K basically confirms the previous study based on integrated film data recorded at room temperature [Miller & Schlemper (1972 ▸). Inorg. Chem. 12, 677–681], but reveals a remarkable shrinkage of the a axis [7.12 (1) > 6.7694 (4) Å]. The molecule belongs to point group C(i) with the Sn(IV) atom on a centre of inversion. The Sn(IV) atom shows a slightly distorted octahedral coordination sphere with the methyl groups in trans positions and a Sn—C bond length of 2.115 (2) Å which may serve as a standard value for an Sn—CH(3) bond of an octahedrally coordinated Sn(IV) atom. The Sn—O bonds involving the two carbonyl groups of the acetylacetonate ligand are of equal length [2.180 (1) and 2.183 (1) Å], as are the C=O [1.273 (1) and 1.274 (1) Å] and C—C bond lengths [1.393 (2) and 1.400 (2) Å]. The acetylacetonate ligand deviates considerably from planarity, with a dihedral angle of 5.57 (9)° between the least-squares planes of the two acetone moieties. The four O atoms of the two symmetry-related acetylacetonate ligands are arranged in a nearly quadratic rectangle. Weak C—H⋯O interactions consolidate the crystal packing. |
format | Online Article Text |
id | pubmed-5382601 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2017 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-53826012017-04-21 Redetermination of the crystal structure of dimethylbis[2,4-pentanedionato(1−)-κ(2) O (2),O (4)]tin(IV) Reuter, Hans Reichelt, Martin Acta Crystallogr E Crystallogr Commun Research Communications The redetermination of the title compound, [Sn(CH(3))(2)(C(5)H(7)O(2))(2)] or SnMe(2)(acac)(2), from CCD data recorded at 100 K basically confirms the previous study based on integrated film data recorded at room temperature [Miller & Schlemper (1972 ▸). Inorg. Chem. 12, 677–681], but reveals a remarkable shrinkage of the a axis [7.12 (1) > 6.7694 (4) Å]. The molecule belongs to point group C(i) with the Sn(IV) atom on a centre of inversion. The Sn(IV) atom shows a slightly distorted octahedral coordination sphere with the methyl groups in trans positions and a Sn—C bond length of 2.115 (2) Å which may serve as a standard value for an Sn—CH(3) bond of an octahedrally coordinated Sn(IV) atom. The Sn—O bonds involving the two carbonyl groups of the acetylacetonate ligand are of equal length [2.180 (1) and 2.183 (1) Å], as are the C=O [1.273 (1) and 1.274 (1) Å] and C—C bond lengths [1.393 (2) and 1.400 (2) Å]. The acetylacetonate ligand deviates considerably from planarity, with a dihedral angle of 5.57 (9)° between the least-squares planes of the two acetone moieties. The four O atoms of the two symmetry-related acetylacetonate ligands are arranged in a nearly quadratic rectangle. Weak C—H⋯O interactions consolidate the crystal packing. International Union of Crystallography 2017-03-03 /pmc/articles/PMC5382601/ /pubmed/28435700 http://dx.doi.org/10.1107/S2056989017003206 Text en © Reuter and Reichelt 2017 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.http://creativecommons.org/licenses/by/2.0/uk/ |
spellingShingle | Research Communications Reuter, Hans Reichelt, Martin Redetermination of the crystal structure of dimethylbis[2,4-pentanedionato(1−)-κ(2) O (2),O (4)]tin(IV) |
title | Redetermination of the crystal structure of dimethylbis[2,4-pentanedionato(1−)-κ(2)
O
(2),O
(4)]tin(IV) |
title_full | Redetermination of the crystal structure of dimethylbis[2,4-pentanedionato(1−)-κ(2)
O
(2),O
(4)]tin(IV) |
title_fullStr | Redetermination of the crystal structure of dimethylbis[2,4-pentanedionato(1−)-κ(2)
O
(2),O
(4)]tin(IV) |
title_full_unstemmed | Redetermination of the crystal structure of dimethylbis[2,4-pentanedionato(1−)-κ(2)
O
(2),O
(4)]tin(IV) |
title_short | Redetermination of the crystal structure of dimethylbis[2,4-pentanedionato(1−)-κ(2)
O
(2),O
(4)]tin(IV) |
title_sort | redetermination of the crystal structure of dimethylbis[2,4-pentanedionato(1−)-κ(2)
o
(2),o
(4)]tin(iv) |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5382601/ https://www.ncbi.nlm.nih.gov/pubmed/28435700 http://dx.doi.org/10.1107/S2056989017003206 |
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