Synthesis and crystal structure of poly[(2,6-dimethylpyrazine-κ <i>N</i> <sup>4</sup> )(μ <sub>3</sub> -thiocyanato-κ <sup>3</sup> <i>N</i> : <i>S</i> : <i>S</i> )copper(I)]

Crystals of the title compound, [Cu(NCS)(C<sub>6</sub>H<sub>8</sub>N<sub>2</sub>)] <sub><i>n</i></sub> (C<sub>6</sub>H<sub>8</sub>N<sub>2</sub> = 2,6-di-methyl-pyrazine), were prepared by the reaction of CuNCS and 2,6-di-methyl-pyrazine in aceto-nitrile. The asymmetric unit consists of one Cu<sup>I</sup> cation, one thio-cyanate anion and one 2,6-di-methyl-pyrazine ligand with all atoms lying on general positions. The copper cations are tetra-hedrally coordinated by two S- and one N-bonded thio-cyanate anions and one 2,6-di-methyl-pyrazine ligand, which s coordinated to the metal center with the N atom that is not adjacent to the methyl groups. The copper cations are linked by the μ-1,3,3 (<i>N</i>,<i>S</i>,<i>S</i>) bridging thio-cyanate anions into layers that lie parallel to the <i>ac</i> plane. The layers are stacked perpendicular to the <i>b</i>-axis direction and are separated by the 2,6-di-methyl-pyrazine ligands. The title crystal structure is compared with those of related CuNCS compounds with isomeric di-methyl-pyrazine ligands.

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Journal
Acta Crystallographica Section E Crystallographic Communications
Published
2026-02-24
DOI
https://doi.org/10.1107/s2056989026001866
Primary Topic
Crystal structures of chemical compounds
Type
article
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article

Synthesis and crystal structure of poly[(2,6-dimethylpyrazine-κ N 4 )(μ 3 -thiocyanato-κ 3 N : S : S )copper(I)]

Christian Näther
Acta Crystallographica Section E Crystallographic Communications
Crystal structures of chemical compounds
article

Synthesis and crystal structure of poly[(2,6-dimethylpyrazine-κ N 4 )(μ 3 -thiocyanato-κ 3 N : S : S )copper(I)]

Christian Näther
article en

Abstract

Crystals of the title compound, [Cu(NCS)(C<sub>6</sub>H<sub>8</sub>N<sub>2</sub>)] <sub><i>n</i></sub> (C<sub>6</sub>H<sub>8</sub>N<sub>2</sub> = 2,6-di-methyl-pyrazine), were prepared by the reaction of CuNCS and 2,6-di-methyl-pyrazine in aceto-nitrile. The asymmetric unit consists of one Cu<sup>I</sup> cation, one thio-cyanate anion and one 2,6-di-methyl-pyrazine ligand with all atoms lying on general positions. The copper cations are tetra-hedrally coordinated by two S- and one N-bonded thio-cyanate anions and one 2,6-di-methyl-pyrazine ligand, which s coordinated to the metal center with the N atom that is not adjacent to the methyl groups. The copper cations are linked by the μ-1,3,3 (<i>N</i>,<i>S</i>,<i>S</i>) bridging thio-cyanate anions into layers that lie parallel to the <i>ac</i> plane. The layers are stacked perpendicular to the <i>b</i>-axis direction and are separated by the 2,6-di-methyl-pyrazine ligands. The title crystal structure is compared with those of related CuNCS compounds with isomeric di-methyl-pyrazine ligands.

Acta Crystallographica Section E Crystallographic CommunicationsVol. 82(3)
Christian-Albrechts-Universität zu Kiel (DE)
Openalex Percentile: Top 45%
Crystal structures of chemical compounds
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