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Syntheses and crystal structures of bis(4-methylpyridine-κN)bis(selenocyanato-κN)zinc(II) and catena-poly[[bis(4-methylpyridine-κN)cadmium(II)]-di-μ-selenocyanato-κ(2) N:Se;κ(2) Se:N]
The reactions of Zn(NO(3))(2) (.)6H(2)O and Cd(NO(3))(2) (.)4H(2)O with KSeCN and 4-methylpyridine (C(6)H(7)N; 4-picoline) lead to the formation of crystals of bis(4-methylpyridine-κN)bis(selenocyanato-κN)zinc(II), [Cd(NCSe)(2)(C(6)H(7)N)(2)] (1), and catena-poly[[bis(4-methylpyridine-κN)cad...
Autores principales: | , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
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International Union of Crystallography
2023
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9993905/ https://www.ncbi.nlm.nih.gov/pubmed/36910001 http://dx.doi.org/10.1107/S2056989023000920 |
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author | Näther, Christian Jess, Inke |
author_facet | Näther, Christian Jess, Inke |
author_sort | Näther, Christian |
collection | PubMed |
description | The reactions of Zn(NO(3))(2) (.)6H(2)O and Cd(NO(3))(2) (.)4H(2)O with KSeCN and 4-methylpyridine (C(6)H(7)N; 4-picoline) lead to the formation of crystals of bis(4-methylpyridine-κN)bis(selenocyanato-κN)zinc(II), [Cd(NCSe)(2)(C(6)H(7)N)(2)] (1), and catena-poly[[bis(4-methylpyridine-κN)cadmium(II)]-di-μ-selenocyanato-κ(2) N:Se;κ(2) Se:N], [Cd(NCSe)(2)(C(6)H(7)N)(2)]( n ) (2), suitable for single-crystal X-ray diffraction. The asymmetric unit of compound 1 consists of one Zn cation that is located on a twofold rotation axis as well as one selenocyanate anion and one 4-methylpyridine ligand in general positions. The Zn cations are tetrahedrally coordinated by two terminal N-bonding thiocyanate anions and two 4-methylpyridine ligands, forming discrete complexes. The asymmetric unit of compound 2 consists of two crystallographically independent Cd cations, of which one is located on a twofold rotation axis and the second on a center of inversion, as well as two crystallographically independent selenocyanate anions and two crystallographically independent 4-methylpyridine ligands in general positions. The Cd cations are octahedrally coordinated by two N- and two S-bonding selenocyanate anions and two 4-methylpyridine ligands and are linked into chains by pairs of selenocyanate anions. Within the chains, the Cd cations show an alternating cis–cis–trans and all-trans coordination and therefore, the chains are corrugated. PXRD investigations prove that the Zn compound was obtained as a pure phase and that the Cd compound contains a very small amount of an additional and unknown phase. In the IR spectrum of 1, the CN stretching vibration of the selenocyanate anion is observed at 2072 cm(−1), whereas in the 2 it is shifted to 2094 cm(−1), in agreement with the crystal structures. |
format | Online Article Text |
id | pubmed-9993905 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2023 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-99939052023-03-09 Syntheses and crystal structures of bis(4-methylpyridine-κN)bis(selenocyanato-κN)zinc(II) and catena-poly[[bis(4-methylpyridine-κN)cadmium(II)]-di-μ-selenocyanato-κ(2) N:Se;κ(2) Se:N] Näther, Christian Jess, Inke Acta Crystallogr E Crystallogr Commun Research Communications The reactions of Zn(NO(3))(2) (.)6H(2)O and Cd(NO(3))(2) (.)4H(2)O with KSeCN and 4-methylpyridine (C(6)H(7)N; 4-picoline) lead to the formation of crystals of bis(4-methylpyridine-κN)bis(selenocyanato-κN)zinc(II), [Cd(NCSe)(2)(C(6)H(7)N)(2)] (1), and catena-poly[[bis(4-methylpyridine-κN)cadmium(II)]-di-μ-selenocyanato-κ(2) N:Se;κ(2) Se:N], [Cd(NCSe)(2)(C(6)H(7)N)(2)]( n ) (2), suitable for single-crystal X-ray diffraction. The asymmetric unit of compound 1 consists of one Zn cation that is located on a twofold rotation axis as well as one selenocyanate anion and one 4-methylpyridine ligand in general positions. The Zn cations are tetrahedrally coordinated by two terminal N-bonding thiocyanate anions and two 4-methylpyridine ligands, forming discrete complexes. The asymmetric unit of compound 2 consists of two crystallographically independent Cd cations, of which one is located on a twofold rotation axis and the second on a center of inversion, as well as two crystallographically independent selenocyanate anions and two crystallographically independent 4-methylpyridine ligands in general positions. The Cd cations are octahedrally coordinated by two N- and two S-bonding selenocyanate anions and two 4-methylpyridine ligands and are linked into chains by pairs of selenocyanate anions. Within the chains, the Cd cations show an alternating cis–cis–trans and all-trans coordination and therefore, the chains are corrugated. PXRD investigations prove that the Zn compound was obtained as a pure phase and that the Cd compound contains a very small amount of an additional and unknown phase. In the IR spectrum of 1, the CN stretching vibration of the selenocyanate anion is observed at 2072 cm(−1), whereas in the 2 it is shifted to 2094 cm(−1), in agreement with the crystal structures. International Union of Crystallography 2023-02-07 /pmc/articles/PMC9993905/ /pubmed/36910001 http://dx.doi.org/10.1107/S2056989023000920 Text en © Näther and Jess 2023 https://creativecommons.org/licenses/by/4.0/This is an open-access article distributed under the terms of the Creative Commons Attribution (CC-BY) Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited. |
spellingShingle | Research Communications Näther, Christian Jess, Inke Syntheses and crystal structures of bis(4-methylpyridine-κN)bis(selenocyanato-κN)zinc(II) and catena-poly[[bis(4-methylpyridine-κN)cadmium(II)]-di-μ-selenocyanato-κ(2) N:Se;κ(2) Se:N] |
title | Syntheses and crystal structures of bis(4-methylpyridine-κN)bis(selenocyanato-κN)zinc(II) and catena-poly[[bis(4-methylpyridine-κN)cadmium(II)]-di-μ-selenocyanato-κ(2)
N:Se;κ(2)
Se:N] |
title_full | Syntheses and crystal structures of bis(4-methylpyridine-κN)bis(selenocyanato-κN)zinc(II) and catena-poly[[bis(4-methylpyridine-κN)cadmium(II)]-di-μ-selenocyanato-κ(2)
N:Se;κ(2)
Se:N] |
title_fullStr | Syntheses and crystal structures of bis(4-methylpyridine-κN)bis(selenocyanato-κN)zinc(II) and catena-poly[[bis(4-methylpyridine-κN)cadmium(II)]-di-μ-selenocyanato-κ(2)
N:Se;κ(2)
Se:N] |
title_full_unstemmed | Syntheses and crystal structures of bis(4-methylpyridine-κN)bis(selenocyanato-κN)zinc(II) and catena-poly[[bis(4-methylpyridine-κN)cadmium(II)]-di-μ-selenocyanato-κ(2)
N:Se;κ(2)
Se:N] |
title_short | Syntheses and crystal structures of bis(4-methylpyridine-κN)bis(selenocyanato-κN)zinc(II) and catena-poly[[bis(4-methylpyridine-κN)cadmium(II)]-di-μ-selenocyanato-κ(2)
N:Se;κ(2)
Se:N] |
title_sort | syntheses and crystal structures of bis(4-methylpyridine-κn)bis(selenocyanato-κn)zinc(ii) and catena-poly[[bis(4-methylpyridine-κn)cadmium(ii)]-di-μ-selenocyanato-κ(2)
n:se;κ(2)
se:n] |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9993905/ https://www.ncbi.nlm.nih.gov/pubmed/36910001 http://dx.doi.org/10.1107/S2056989023000920 |
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