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Crystal structure of bis(benzoato-κO)dibutyltin(IV), nBu(2)Sn(bzo)(2)
The title compound, [Sn(C(4)H(9))(2)(C(6)H(5)COO)(2)], was synthesized in order to study the interaction between di-n-butyltin(IV) oxide and some carboxylic acids. Di-n-butyltin(IV) dibenzoate, nBu(2)Sn(obz)(2), exhibits the same structural features as other diorganotin(IV) dibenzoates characte...
Autores principales: | , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2016
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4992901/ https://www.ncbi.nlm.nih.gov/pubmed/27555926 http://dx.doi.org/10.1107/S2056989016008604 |
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author | Reuter, Hans Okio, Coco K. Y. A. |
author_facet | Reuter, Hans Okio, Coco K. Y. A. |
author_sort | Reuter, Hans |
collection | PubMed |
description | The title compound, [Sn(C(4)H(9))(2)(C(6)H(5)COO)(2)], was synthesized in order to study the interaction between di-n-butyltin(IV) oxide and some carboxylic acids. Di-n-butyltin(IV) dibenzoate, nBu(2)Sn(obz)(2), exhibits the same structural features as other diorganotin(IV) dibenzoates characterized by an unsymmetrical bidentate bonding mode [Δ(Sn—O) ≃ 0.4 Å] of the two benzoate groups to tin. In a first approximation, the coordination sphere at tin resulting from the two stronger bonded O atoms [2.1227 (17) and 2.1405 (16) Å] and the two α-C atoms of the n-butyl groups [2.125 (3) and 2.129 (2) Å] is compressed to a tetragonal disphenoid [〈(C—Sn—C) = 148.2 (1)° and 〈(O—Sn—O) = 82.01 (6)°]. This coordination sphere is expanded by the less strongly bonded two O atoms [2.507 (2) and 2.485 (2) Å] to a substantially distorted octahedron and by a weak intermolecular Sn⋯O interaction [2.943 (2) Å] to a pentagonal bipyramid with the formation of centrosymmetric dimers. The unbranched butyl groups adopt two different conformations: anti–gauche [torsion angles: 166.0 (2)–63.9 (4)°] and gauche–gauche [65.0 (3)–56.3 (3)°]. Intermolecular interactions between the dimers are restricted to O⋯H—C contacts (2.64 Å) and van der Waals interactions. |
format | Online Article Text |
id | pubmed-4992901 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2016 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-49929012016-08-23 Crystal structure of bis(benzoato-κO)dibutyltin(IV), nBu(2)Sn(bzo)(2) Reuter, Hans Okio, Coco K. Y. A. Acta Crystallogr E Crystallogr Commun Research Communications The title compound, [Sn(C(4)H(9))(2)(C(6)H(5)COO)(2)], was synthesized in order to study the interaction between di-n-butyltin(IV) oxide and some carboxylic acids. Di-n-butyltin(IV) dibenzoate, nBu(2)Sn(obz)(2), exhibits the same structural features as other diorganotin(IV) dibenzoates characterized by an unsymmetrical bidentate bonding mode [Δ(Sn—O) ≃ 0.4 Å] of the two benzoate groups to tin. In a first approximation, the coordination sphere at tin resulting from the two stronger bonded O atoms [2.1227 (17) and 2.1405 (16) Å] and the two α-C atoms of the n-butyl groups [2.125 (3) and 2.129 (2) Å] is compressed to a tetragonal disphenoid [〈(C—Sn—C) = 148.2 (1)° and 〈(O—Sn—O) = 82.01 (6)°]. This coordination sphere is expanded by the less strongly bonded two O atoms [2.507 (2) and 2.485 (2) Å] to a substantially distorted octahedron and by a weak intermolecular Sn⋯O interaction [2.943 (2) Å] to a pentagonal bipyramid with the formation of centrosymmetric dimers. The unbranched butyl groups adopt two different conformations: anti–gauche [torsion angles: 166.0 (2)–63.9 (4)°] and gauche–gauche [65.0 (3)–56.3 (3)°]. Intermolecular interactions between the dimers are restricted to O⋯H—C contacts (2.64 Å) and van der Waals interactions. International Union of Crystallography 2016-06-03 /pmc/articles/PMC4992901/ /pubmed/27555926 http://dx.doi.org/10.1107/S2056989016008604 Text en © Reuter and Okio 2016 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 | Research Communications Reuter, Hans Okio, Coco K. Y. A. Crystal structure of bis(benzoato-κO)dibutyltin(IV), nBu(2)Sn(bzo)(2) |
title | Crystal structure of bis(benzoato-κO)dibutyltin(IV), nBu(2)Sn(bzo)(2)
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title_full | Crystal structure of bis(benzoato-κO)dibutyltin(IV), nBu(2)Sn(bzo)(2)
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title_fullStr | Crystal structure of bis(benzoato-κO)dibutyltin(IV), nBu(2)Sn(bzo)(2)
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title_full_unstemmed | Crystal structure of bis(benzoato-κO)dibutyltin(IV), nBu(2)Sn(bzo)(2)
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title_short | Crystal structure of bis(benzoato-κO)dibutyltin(IV), nBu(2)Sn(bzo)(2)
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title_sort | crystal structure of bis(benzoato-κo)dibutyltin(iv), nbu(2)sn(bzo)(2) |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4992901/ https://www.ncbi.nlm.nih.gov/pubmed/27555926 http://dx.doi.org/10.1107/S2056989016008604 |
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