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Syntheses and crystal structures of the ethanol, acetonitrile and diethyl ether Werner clathrates bis­(iso­thio­cyanato-κN)tetra­kis­(3-methyl­pyridine-κN)nickel(II)

The reaction of nickel(II)thio­cyanate with 3-methyl­pyridine (3-picoline; C(6)H(7)N) in different solvents leads to the formation of crystals of bis­(iso­thio­cyanato-κN)tetra­kis­(3-methyl­pyridine-κN)nickel(II) as the ethanol disolvate, [Ni(NCS)(2)(C(6)H(7)N)(4)]·2C(2)H(5)OH (1), the acetonitrile...

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Autores principales: Krebs, Christoph, Jess, Inke, Näther, Christian
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9535821/
https://www.ncbi.nlm.nih.gov/pubmed/36250119
http://dx.doi.org/10.1107/S2056989022008891
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author Krebs, Christoph
Jess, Inke
Näther, Christian
author_facet Krebs, Christoph
Jess, Inke
Näther, Christian
author_sort Krebs, Christoph
collection PubMed
description The reaction of nickel(II)thio­cyanate with 3-methyl­pyridine (3-picoline; C(6)H(7)N) in different solvents leads to the formation of crystals of bis­(iso­thio­cyanato-κN)tetra­kis­(3-methyl­pyridine-κN)nickel(II) as the ethanol disolvate, [Ni(NCS)(2)(C(6)H(7)N)(4)]·2C(2)H(5)OH (1), the acetonitrile disolvate, [Ni(NCS)(2)(C(6)H(7)N)(4)]·2CH(3)CN (2), and the diethyl ether monosolvate, [Ni(NCS)(2)(C(6)H(7)N)(4)]·C(4)H(10)O (3). The crystal structures of these compounds consist of Ni(II) cations coordinated by two N-bonded thio­cyanate anions and four 3-methyl­pyridine ligands to generate NiN(6) octa­hedra with the thio­cyanate groups in a trans orientation. In compounds 1 and 2 these complexes are located on centers of inversion, whereas in compound 3, they occupy general positions. In the crystal structures, the complexes are packed in such a way that cavities are formed in which the solvent mol­ecules are located. Compounds 1 and 2 are isotypic, which is not the case for compound 3. In compounds 1 and 2 the solvate mol­ecules are disordered, whereas they are fully ordered in compound 3. Disorder is also observed for one of the 3-methyl­pyridine ligands in compound 2. Powder X-ray diffraction and IR measurements show that at room temperature all compounds decompose almost immediately into the same phase, as a result of the loss of the solvent mol­ecules.
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spelling pubmed-95358212022-10-13 Syntheses and crystal structures of the ethanol, acetonitrile and diethyl ether Werner clathrates bis­(iso­thio­cyanato-κN)tetra­kis­(3-methyl­pyridine-κN)nickel(II) Krebs, Christoph Jess, Inke Näther, Christian Acta Crystallogr E Crystallogr Commun Research Communications The reaction of nickel(II)thio­cyanate with 3-methyl­pyridine (3-picoline; C(6)H(7)N) in different solvents leads to the formation of crystals of bis­(iso­thio­cyanato-κN)tetra­kis­(3-methyl­pyridine-κN)nickel(II) as the ethanol disolvate, [Ni(NCS)(2)(C(6)H(7)N)(4)]·2C(2)H(5)OH (1), the acetonitrile disolvate, [Ni(NCS)(2)(C(6)H(7)N)(4)]·2CH(3)CN (2), and the diethyl ether monosolvate, [Ni(NCS)(2)(C(6)H(7)N)(4)]·C(4)H(10)O (3). The crystal structures of these compounds consist of Ni(II) cations coordinated by two N-bonded thio­cyanate anions and four 3-methyl­pyridine ligands to generate NiN(6) octa­hedra with the thio­cyanate groups in a trans orientation. In compounds 1 and 2 these complexes are located on centers of inversion, whereas in compound 3, they occupy general positions. In the crystal structures, the complexes are packed in such a way that cavities are formed in which the solvent mol­ecules are located. Compounds 1 and 2 are isotypic, which is not the case for compound 3. In compounds 1 and 2 the solvate mol­ecules are disordered, whereas they are fully ordered in compound 3. Disorder is also observed for one of the 3-methyl­pyridine ligands in compound 2. Powder X-ray diffraction and IR measurements show that at room temperature all compounds decompose almost immediately into the same phase, as a result of the loss of the solvent mol­ecules. International Union of Crystallography 2022-09-08 /pmc/articles/PMC9535821/ /pubmed/36250119 http://dx.doi.org/10.1107/S2056989022008891 Text en © Krebs 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
Krebs, Christoph
Jess, Inke
Näther, Christian
Syntheses and crystal structures of the ethanol, acetonitrile and diethyl ether Werner clathrates bis­(iso­thio­cyanato-κN)tetra­kis­(3-methyl­pyridine-κN)nickel(II)
title Syntheses and crystal structures of the ethanol, acetonitrile and diethyl ether Werner clathrates bis­(iso­thio­cyanato-κN)tetra­kis­(3-methyl­pyridine-κN)nickel(II)
title_full Syntheses and crystal structures of the ethanol, acetonitrile and diethyl ether Werner clathrates bis­(iso­thio­cyanato-κN)tetra­kis­(3-methyl­pyridine-κN)nickel(II)
title_fullStr Syntheses and crystal structures of the ethanol, acetonitrile and diethyl ether Werner clathrates bis­(iso­thio­cyanato-κN)tetra­kis­(3-methyl­pyridine-κN)nickel(II)
title_full_unstemmed Syntheses and crystal structures of the ethanol, acetonitrile and diethyl ether Werner clathrates bis­(iso­thio­cyanato-κN)tetra­kis­(3-methyl­pyridine-κN)nickel(II)
title_short Syntheses and crystal structures of the ethanol, acetonitrile and diethyl ether Werner clathrates bis­(iso­thio­cyanato-κN)tetra­kis­(3-methyl­pyridine-κN)nickel(II)
title_sort syntheses and crystal structures of the ethanol, acetonitrile and diethyl ether werner clathrates bis­(iso­thio­cyanato-κn)tetra­kis­(3-methyl­pyridine-κn)nickel(ii)
topic Research Communications
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9535821/
https://www.ncbi.nlm.nih.gov/pubmed/36250119
http://dx.doi.org/10.1107/S2056989022008891
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