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Rerefinement of poly[diaquabis(μ(3)-2-methylpropanoato-κ(4) O:O,O′:O′)bis(μ(3)-2-methylpropanoato-κ(3) O:O:O)(μ(2)-2-methylpropanoato-κ(3) O:O,O′)(2-methylpropanoato-κ(2) O,O′)trilead(II)]
The crystal structure of the title complex, [Pb(3)(C(4)H(7)O(2))(6)(H(2)O)(2)]( n ), was redetermined on basis of modern CCD-based single-crystal X-ray data at 120 K. The current study basically confirms the previous report [Fallon et al. (1997 ▸). Polyhedron, 16, 19–23] at 190 K, but with higher ac...
Autores principales: | , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2020
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9462163/ https://www.ncbi.nlm.nih.gov/pubmed/36339029 http://dx.doi.org/10.1107/S2414314620013115 |
Sumario: | The crystal structure of the title complex, [Pb(3)(C(4)H(7)O(2))(6)(H(2)O)(2)]( n ), was redetermined on basis of modern CCD-based single-crystal X-ray data at 120 K. The current study basically confirms the previous report [Fallon et al. (1997 ▸). Polyhedron, 16, 19–23] at 190 K, but with higher accuracy and precision. In particular, positional disorder of one of the 2-methylpropanoate anions over two sets of sites was resolved, showing a refined ratio of the disorder components of 0.535 (9):0.465 (9). The three independent cations in the structure have coordination numbers of [7 + 1], [6 + 1], and [5 + 3], with O atoms belonging either to carboxylate groups or water molecules. This arrangement leads to the formation of sheets parallel to ( [Image: see text] 01), whereby the hydrophobic 2-methylpropanyl groups of the anions are oriented above and below the hydrophilic sheets to form a layered structure. Within a sheet, hydrogen bonds of the type O(water)—H⋯O are formed, whereas the hydrophobic groups between adjacent layers interact through van der Waals forces. [Image: see text] |
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