Cargando…
Synthesis, crystal structure and properties of catena-poly[[[bis(3-methylpyridine-κN)nickel(II)]-di-μ-1,3-thiocyanato] acetonitrile monosolvate]
In the crystal structure of the title compound, {[Ni(NCS)(2)(C(6)H(7)N)(2)]·CH(3)CN}( n ), the Ni(II) cation is octahedrally coordinated by two N-bonding and two S-bonding thiocyanate anions, as well as two 3-methylpyridine coligands, with the thiocyanate S atoms and the 3-methylpyridine N atom...
Autores principales: | , , |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2022
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9638983/ https://www.ncbi.nlm.nih.gov/pubmed/36380903 http://dx.doi.org/10.1107/S2056989022009598 |
_version_ | 1784825541603360768 |
---|---|
author | Näther, Christian Jess, Inke Krebs, Christoph |
author_facet | Näther, Christian Jess, Inke Krebs, Christoph |
author_sort | Näther, Christian |
collection | PubMed |
description | In the crystal structure of the title compound, {[Ni(NCS)(2)(C(6)H(7)N)(2)]·CH(3)CN}( n ), the Ni(II) cation is octahedrally coordinated by two N-bonding and two S-bonding thiocyanate anions, as well as two 3-methylpyridine coligands, with the thiocyanate S atoms and the 3-methylpyridine N atoms in cis-positions. The metal cations are linked by pairs of thiocyanate anions into chains that, because of the cis–cis–trans coordination, are corrugated. These chains are arranged in such a way that channels are formed in which disordered acetonitrile solvate molecules are located. This overall structural motif is very similar to that observed in Ni(NCS)(2)[4-(boc-amino)pyridine](2)·CH(3)CN reported in the literature. At room temperature, the title compound loses its solvent molecules within a few hours, leading to a crystalline phase that is structurally related to that of the pristine material. If the ansolvate is stored in an acetonitrile atmosphere, the solvate is formed again. Single-crystal X-ray analysis at room-temperature proves that the crystals decompose immediately, presumably because of the loss of solvent molecules, and from the reciprocal space plots it is obvious that this reaction, in contrast to that in Ni(NCS)(2)[4-(boc-amino)pyridine](2)·CH(3)CN, does not proceed via a topotactic reaction. |
format | Online Article Text |
id | pubmed-9638983 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2022 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
spelling | pubmed-96389832022-11-14 Synthesis, crystal structure and properties of catena-poly[[[bis(3-methylpyridine-κN)nickel(II)]-di-μ-1,3-thiocyanato] acetonitrile monosolvate] Näther, Christian Jess, Inke Krebs, Christoph Acta Crystallogr E Crystallogr Commun Research Communications In the crystal structure of the title compound, {[Ni(NCS)(2)(C(6)H(7)N)(2)]·CH(3)CN}( n ), the Ni(II) cation is octahedrally coordinated by two N-bonding and two S-bonding thiocyanate anions, as well as two 3-methylpyridine coligands, with the thiocyanate S atoms and the 3-methylpyridine N atoms in cis-positions. The metal cations are linked by pairs of thiocyanate anions into chains that, because of the cis–cis–trans coordination, are corrugated. These chains are arranged in such a way that channels are formed in which disordered acetonitrile solvate molecules are located. This overall structural motif is very similar to that observed in Ni(NCS)(2)[4-(boc-amino)pyridine](2)·CH(3)CN reported in the literature. At room temperature, the title compound loses its solvent molecules within a few hours, leading to a crystalline phase that is structurally related to that of the pristine material. If the ansolvate is stored in an acetonitrile atmosphere, the solvate is formed again. Single-crystal X-ray analysis at room-temperature proves that the crystals decompose immediately, presumably because of the loss of solvent molecules, and from the reciprocal space plots it is obvious that this reaction, in contrast to that in Ni(NCS)(2)[4-(boc-amino)pyridine](2)·CH(3)CN, does not proceed via a topotactic reaction. International Union of Crystallography 2022-10-06 /pmc/articles/PMC9638983/ /pubmed/36380903 http://dx.doi.org/10.1107/S2056989022009598 Text en © Näther et al. 2022 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 Krebs, Christoph Synthesis, crystal structure and properties of catena-poly[[[bis(3-methylpyridine-κN)nickel(II)]-di-μ-1,3-thiocyanato] acetonitrile monosolvate] |
title | Synthesis, crystal structure and properties of catena-poly[[[bis(3-methylpyridine-κN)nickel(II)]-di-μ-1,3-thiocyanato] acetonitrile monosolvate] |
title_full | Synthesis, crystal structure and properties of catena-poly[[[bis(3-methylpyridine-κN)nickel(II)]-di-μ-1,3-thiocyanato] acetonitrile monosolvate] |
title_fullStr | Synthesis, crystal structure and properties of catena-poly[[[bis(3-methylpyridine-κN)nickel(II)]-di-μ-1,3-thiocyanato] acetonitrile monosolvate] |
title_full_unstemmed | Synthesis, crystal structure and properties of catena-poly[[[bis(3-methylpyridine-κN)nickel(II)]-di-μ-1,3-thiocyanato] acetonitrile monosolvate] |
title_short | Synthesis, crystal structure and properties of catena-poly[[[bis(3-methylpyridine-κN)nickel(II)]-di-μ-1,3-thiocyanato] acetonitrile monosolvate] |
title_sort | synthesis, crystal structure and properties of catena-poly[[[bis(3-methylpyridine-κn)nickel(ii)]-di-μ-1,3-thiocyanato] acetonitrile monosolvate] |
topic | Research Communications |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9638983/ https://www.ncbi.nlm.nih.gov/pubmed/36380903 http://dx.doi.org/10.1107/S2056989022009598 |
work_keys_str_mv | AT natherchristian synthesiscrystalstructureandpropertiesofcatenapolybis3methylpyridineknnickeliidim13thiocyanatoacetonitrilemonosolvate AT jessinke synthesiscrystalstructureandpropertiesofcatenapolybis3methylpyridineknnickeliidim13thiocyanatoacetonitrilemonosolvate AT krebschristoph synthesiscrystalstructureandpropertiesofcatenapolybis3methylpyridineknnickeliidim13thiocyanatoacetonitrilemonosolvate |