Crystal structure of poly[μ<sub>3</sub>-acetato-diaqua-μ<sub>3</sub>-sulfato-cerium(III)]: serendipitous synthesis of a layered coordination polymer exhibiting interlayer O—H...O hydrogen bonding

Single crystals of the title compound, [Ce(CH<sub>3</sub>COO)(SO<sub>4</sub>)(H<sub>2</sub>O)<sub>2</sub>] <sub><i>n</i></sub> , were obtained serendipitously by the reaction of Ce(NO<sub>3</sub>)<sub>3</sub>·6H<sub>2</sub>O with 2,5-thio-phenedi-carb-oxy-lic acid (H<sub>2</sub>TDC) and acetic acid in a mixture of ethanol and water, where it is assumed that the sulfate ions leached from the Teflon reactor, which was treated with per-oxy-monosulfuric acid prior to its use. Its asymmetric unit consists of one Ce<sup>III</sup> cation, one sulfate dianion, one acetate anion and two crystallographically independent water mol-ecules, all of them located in general positions. The cerium cations are coordinated by three acetate anions (one <i>O</i>,<i>O</i>-chelating) and three sulfate dianions that are related by symmetry as well as two independent water mol-ecules within an irregular CeO<sub>9</sub> coordination geometry. The Ce<sup>III</sup> cations are linked by the acetate ions into [010] chains, which are further connected into (001) layers by the sulfate dianions. Intra-layer and inter-layer O-H⋯O hydrogen bonds are observed. Powder X-ray diffraction shows that only traces of the title compound have formed together with a large amount of an unknown crystalline phase. Attempts to prepare the title compound in larger amounts and as a pure phase were unsuccessful.

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Journal
Acta Crystallographica Section E Crystallographic Communications
Published
2025-01-10
DOI
https://doi.org/10.1107/s2056989024012313
Primary Topic
Metal-Organic Frameworks: Synthesis and Applications
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article
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article

Crystal structure of poly[μ3-acetato-diaqua-μ3-sulfato-cerium(III)]: serendipitous synthesis of a layered coordination polymer exhibiting interlayer O—H...O hydrogen bonding

Christian Näther, Niklas Ruser, Norbert Stock
Acta Crystallographica Section E Crystallographic Communications
Metal-Organic Frameworks: Synthesis and Applications
article

Crystal structure of poly[μ3-acetato-diaqua-μ3-sulfato-cerium(III)]: serendipitous synthesis of a layered coordination polymer exhibiting interlayer O—H...O hydrogen bonding

Christian Näther, Niklas Ruser, Norbert Stock
article en

Abstract

Single crystals of the title compound, [Ce(CH<sub>3</sub>COO)(SO<sub>4</sub>)(H<sub>2</sub>O)<sub>2</sub>] <sub><i>n</i></sub> , were obtained serendipitously by the reaction of Ce(NO<sub>3</sub>)<sub>3</sub>·6H<sub>2</sub>O with 2,5-thio-phenedi-carb-oxy-lic acid (H<sub>2</sub>TDC) and acetic acid in a mixture of ethanol and water, where it is assumed that the sulfate ions leached from the Teflon reactor, which was treated with per-oxy-monosulfuric acid prior to its use. Its asymmetric unit consists of one Ce<sup>III</sup> cation, one sulfate dianion, one acetate anion and two crystallographically independent water mol-ecules, all of them located in general positions. The cerium cations are coordinated by three acetate anions (one <i>O</i>,<i>O</i>-chelating) and three sulfate dianions that are related by symmetry as well as two independent water mol-ecules within an irregular CeO<sub>9</sub> coordination geometry. The Ce<sup>III</sup> cations are linked by the acetate ions into [010] chains, which are further connected into (001) layers by the sulfate dianions. Intra-layer and inter-layer O-H⋯O hydrogen bonds are observed. Powder X-ray diffraction shows that only traces of the title compound have formed together with a large amount of an unknown crystalline phase. Attempts to prepare the title compound in larger amounts and as a pure phase were unsuccessful.

Acta Crystallographica Section E Crystallographic CommunicationsVol. 81(2)
Christian-Albrechts-Universität zu Kiel (DE)
Deutsche Forschungsgemeinschaft
Clean water and sanitation
Openalex Percentile: Top 100%
Metal-Organic Frameworks: Synthesis and Applications
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Crystal structure of poly[μ<sub>3</sub>-acetato-diaqua-μ<sub>3</sub>-sulfato-cerium(III)]: serendipitous synthesis of a layered coordination polymer exhibiting interlayer O—H...O hydrogen bonding — Christian Näther, Niklas Ruser, et al. · Acta Crystallographica Section E Crystallographic Communications (2025) | TGRS Research Map | TGRS