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Bis(μ-benzoato-κ(2) O:O′)bis(benzoato-κO)octabutyldi-μ(3)-oxido-tetratin(IV)
The asymmetric unit of the title compound, [{Sn(C(4)H(9))(2)(C(6)H(5)COO)}(2)O](2), consists of two half molecules, completed by application of inversion symmetry. Both molecules adopt a ladder structure typical for this class of dimeric tetraorganodistannoxane dicarboxylates characterized by a...
Autores principales: | , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2017
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5347045/ https://www.ncbi.nlm.nih.gov/pubmed/28316800 http://dx.doi.org/10.1107/S2056989017001505 |
Sumario: | The asymmetric unit of the title compound, [{Sn(C(4)H(9))(2)(C(6)H(5)COO)}(2)O](2), consists of two half molecules, completed by application of inversion symmetry. Both molecules adopt a ladder structure typical for this class of dimeric tetraorganodistannoxane dicarboxylates characterized by a centrosymmetric four-membered (Sn—O)(2) ring of rhomboidal shape that is extended on both sides by folded six-membered Sn—O—C rings. To a first approximation, both kinds of Sn atoms (Sn(i) and Sn(o)) are trigonal–bipyramidally coordinated. The bond angles between the n-butyl groups are widened [135.64 (7)–146.20 (7)°] in comparison with an ideal trigonal bipyramid. Sn—O bond lengths within the {R (2)SnO(3)} coordination sphere depend strongly on the position of the corresponding O atom – axial (ax) or equatorial (eq) – as well as on the functionality of the carboxylate groups which exhibit μ(2) (–COO(i)) and μ(1) (–COO(o)) coordination modes, respectively. In summary, the following sequence of distances [mean values] is found: d(Sn(o)—Oμ(3))(eq) [2.024 (2) Å] < d(Sn(i)—Oμ(3))(eq) [2.044 (2) Å] < d(Sn(i)—Oμ(3))(ax) [2.158 (6) Å] < d(Sn(o)—Oμ(1)-carb)(ax) [2.182 (6) Å] < d(Sn(i)—Oμ(2)-carb)(ax) [2.250 (2) Å] ≃ d(Sn(o)—Oμ(2)-carb)(ax) [2.247 (12) Å]. The n-butyl groups adopt an anti–anti conformation with exception of two disordered outer n-butyl groups of the second molecule which exhibit gauche–anti and anti–gauche conformations. Weak intramolecular Sn⋯O interactions between the different O atoms of the outer carboxyl groups with the inner, as well as outer, Sn atoms give rise to a strongly distorted octahedral coordination at these Sn atoms. Intermolecular interactions between the individual molecules are restricted to van der Waals and O⋯H—C interactions of which a nearly linear very short C—H⋯O contact between the H atom of the phenyl group of one of the molecules with the outer non-coordinating C=O group of the other molecule is the most prominent. It gives rise to a chain-like arrangement of the molecules along [111]. The two n-butyl groups attached to the outer Sn atom of one molecule are disordered over two sets of sites with occupancies of 0.806 (3)/0.194 (3) and 0.702 (3)/0.298 (3). |
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