Synthesis and crystal structure of poly[ethanol(μ-4-methylpyridine <i>N</i>-oxide)di-μ-thiocyanato-cobalt(II)]

Reaction of 4-methyl-pyridine <i>N</i>-oxide and Co(NCS)<sub>2</sub> in ethanol as solvent accidentally leads to the formation of single crystals of Co(NCS)<sub>2</sub>(4-methyl-pyridine <i>N</i>-oxide)(ethanol) or [Co(NCS)<sub>2</sub>(C<sub>6</sub>H<sub>7</sub>NO)(C<sub>2</sub>H<sub>6</sub>O)] <sub><i>n</i></sub> . The asymmetric unit of the title compound consists of one Co<sup>II</sup> cation, two crystallographically independent thio-cyanate anions, one 4-methyl-pyridine <i>N</i>-oxide coligand and one ethanol mol-ecule on general positions. The cobalt cations are sixfold coordinated by one terminal and two bridging thio-cyanate anions, two bridging 4-methyl-pyridine <i>N</i>-oxide coligands and one ethanol mol-ecule, with a slightly distorted octa-hedral geometry. The cobalt cations are linked by single μ-1,3(<i>N</i>,<i>S</i>)-bridging thio-cyanate anions into corrugated chains, that are further connected into layers by pairs of μ-1,1(<i>O</i>,<i>O</i>)-bridging 4-methyl-pyridine <i>N</i>-oxide coligands. The layers are parallel to the <i>bc</i> plane and are separated by the methyl groups of the 4-methyl-pyridine <i>N</i>-oxide coligands. Within the layers, intra-layer hydrogen bonding is observed.

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Journal
Acta Crystallographica Section E Crystallographic Communications
Published
2024-09-20
DOI
https://doi.org/10.1107/s2056989024009058
Primary Topic
Metal-Organic Frameworks: Synthesis and Applications
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article
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article

Synthesis and crystal structure of poly[ethanol(μ-4-methylpyridine N-oxide)di-μ-thiocyanato-cobalt(II)]

Christian Näther, Inke Jeß
Acta Crystallographica Section E Crystallographic Communications
Metal-Organic Frameworks: Synthesis and Applications
article

Synthesis and crystal structure of poly[ethanol(μ-4-methylpyridine N-oxide)di-μ-thiocyanato-cobalt(II)]

Christian Näther, Inke Jeß
article en

Abstract

Reaction of 4-methyl-pyridine <i>N</i>-oxide and Co(NCS)<sub>2</sub> in ethanol as solvent accidentally leads to the formation of single crystals of Co(NCS)<sub>2</sub>(4-methyl-pyridine <i>N</i>-oxide)(ethanol) or [Co(NCS)<sub>2</sub>(C<sub>6</sub>H<sub>7</sub>NO)(C<sub>2</sub>H<sub>6</sub>O)] <sub><i>n</i></sub> . The asymmetric unit of the title compound consists of one Co<sup>II</sup> cation, two crystallographically independent thio-cyanate anions, one 4-methyl-pyridine <i>N</i>-oxide coligand and one ethanol mol-ecule on general positions. The cobalt cations are sixfold coordinated by one terminal and two bridging thio-cyanate anions, two bridging 4-methyl-pyridine <i>N</i>-oxide coligands and one ethanol mol-ecule, with a slightly distorted octa-hedral geometry. The cobalt cations are linked by single μ-1,3(<i>N</i>,<i>S</i>)-bridging thio-cyanate anions into corrugated chains, that are further connected into layers by pairs of μ-1,1(<i>O</i>,<i>O</i>)-bridging 4-methyl-pyridine <i>N</i>-oxide coligands. The layers are parallel to the <i>bc</i> plane and are separated by the methyl groups of the 4-methyl-pyridine <i>N</i>-oxide coligands. Within the layers, intra-layer hydrogen bonding is observed.

Acta Crystallographica Section E Crystallographic CommunicationsVol. 80(10)
Christian-Albrechts-Universität zu Kiel (DE)
Clean water and sanitation
Openalex Percentile: Top 88%
Metal-Organic Frameworks: Synthesis and Applications
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