Structure of tri-aqua-tris-(1,1,1-tri-fluoro-4-oxo-pentan-2-olato)cerium(III) as a possible fluorescent compound.

Acta Crystallogr E Crystallogr Commun

Department of Chemistry and Chemical Engineering, Faculty of Engineering, Niigata University, Ikarashi 2-no-cho, Niigata City, 950-2181, Japan.

Published: February 2018

Luminescence due to the transition of Ce is quite rare in metal-organic complexes where concentrate quenching frequently occurs. One of the possible ways to avoid this is to design an architecture with elongated metal-metal distances. In the structure of the title complex, tri-aqua-tris-(1,1,1-tri-fluoro-4-oxo-pentan-2-olato-κ,')cerium(III), [Ce(CHFO)(HO)], the Ce complex is linked to neighbouring ones by hydrogen bonding. Within the complex, the Ce atom is coordinated by nine O atoms from three 1,1,1-tri-fluoro-4-oxo-pentan-2-olate (tfa) anions as bidentate ligands and three water mol-ecules as monodentate ligands. Thus, the coordination number of Ce atom is nine in a monocapped square-anti-prismatic polyhedron. The F atoms of all three independent CF groups in tfa are disordered over two positions with occupancy ratios of about 0.8:0.2. The inter-molecular hydrogen bonds between the ligands involve tfa-water inter-actions along the [110] and [1-10] directions, generating an overall two-dimensional layered network structure. The presence of the F atoms in the tfa anion is responsible for an increased inter-molecular metal-metal distance compared to that in the analogous acetyl-acetonate (acac) derivatives. Fluorescence from Ce is, however, not observed.

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http://www.ncbi.nlm.nih.gov/pmc/articles/PMC5956343PMC
http://dx.doi.org/10.1107/S2056989018001135DOI Listing

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