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Crystal structure of a third polymorph of tris(acetylacetonato-κ(2) O,O′)iron(III)
In the structure of the title complex, [Fe(C(5)H(7)O(2))(3)] or Fe(acac)(3), the asymmetric unit contains one molecule in a general position. The coordination sphere of the Fe(III) atom is that of a slightly distorted octahedron. The crystal under investigation was a two-component pseudo-merohedral...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2015
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4719847/ https://www.ncbi.nlm.nih.gov/pubmed/26870438 http://dx.doi.org/10.1107/S2056989015021805 |
Sumario: | In the structure of the title complex, [Fe(C(5)H(7)O(2))(3)] or Fe(acac)(3), the asymmetric unit contains one molecule in a general position. The coordination sphere of the Fe(III) atom is that of a slightly distorted octahedron. The crystal under investigation was a two-component pseudo-merohedral twin in the monoclinic system with a β angle close to 90°. Twin law [100/0-10/00-1] reduced the R1 residual [I > 2σ(I)] from 0.0769 to 0.0312, and the mass ratio of twin components refined to 0.8913 (5):0.1087 (5). In the crystal, molecules are arranged in sheets normal to [001] via non-classical C—H⋯O hydrogen bonding. No other significant intermolecular interactions are observed. The structure is a new polymorph of Fe(acac)(3) and is isotypic with one polymorph of its gallium analog. |
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