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Dipotassium tetra­kis­(thio­cyanato-κS)palladate(II)–(2,2′-bipyrimidine-κ(2) N (1),N (1′))bis­(thio­cyanato-κS)palladium(II) (1/2)

The asymmetric unit of the title compound, K(2)[Pd(NCS)(4)]·2[Pd(NCS)(2)(C(8)H(6)N(4))], contains two crystallographically independent half-mol­ecules of the anionic Pd(II) complex, two K(+) cations and two independent neutral Pd(II) complexes; an inversion centre is located at the centroid of each...

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Autor principal: Ha, Kwang
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3344351/
https://www.ncbi.nlm.nih.gov/pubmed/22590117
http://dx.doi.org/10.1107/S1600536812015383
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author Ha, Kwang
author_facet Ha, Kwang
author_sort Ha, Kwang
collection PubMed
description The asymmetric unit of the title compound, K(2)[Pd(NCS)(4)]·2[Pd(NCS)(2)(C(8)H(6)N(4))], contains two crystallographically independent half-mol­ecules of the anionic Pd(II) complex, two K(+) cations and two independent neutral Pd(II) complexes; an inversion centre is located at the centroid of each anionic complex. In the anionic complexes, each Pd(II) ion is four-coordinated in an almost regular square-planar environment by four S atoms from four SCN(−) anions, and the PdS(4) unit is exactly planar. In the neutral complexes, the Pd(II) ion has a slightly distorted square-planar coordination environment defined by two pyrimidine N atoms derived from a chelating 2,2′-bipyrimidine ligand and two mutually cis S atoms from two SCN(−) anions. Both 2,2′-bipyrimidine ligands are almost planar [dihedral angle between the rings = 3.98 (16) and 4.57 (17)°] and also chelate to a potassium ion from their other two N atoms. In the crystal, the K(+) ions inter­act with various S and N atoms of the ligands, forming a three-dimensional polymeric network, in which the shortest K⋯K contacts between the KN(7)S polyhedra are 4.4389 (17) and 4.4966 (18) Å. Intra- and inter­molecular C—H⋯S and C—H⋯N hydrogen bonds are also observed.
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spelling pubmed-33443512012-05-15 Dipotassium tetra­kis­(thio­cyanato-κS)palladate(II)–(2,2′-bipyrimidine-κ(2) N (1),N (1′))bis­(thio­cyanato-κS)palladium(II) (1/2) Ha, Kwang Acta Crystallogr Sect E Struct Rep Online Metal-Organic Papers The asymmetric unit of the title compound, K(2)[Pd(NCS)(4)]·2[Pd(NCS)(2)(C(8)H(6)N(4))], contains two crystallographically independent half-mol­ecules of the anionic Pd(II) complex, two K(+) cations and two independent neutral Pd(II) complexes; an inversion centre is located at the centroid of each anionic complex. In the anionic complexes, each Pd(II) ion is four-coordinated in an almost regular square-planar environment by four S atoms from four SCN(−) anions, and the PdS(4) unit is exactly planar. In the neutral complexes, the Pd(II) ion has a slightly distorted square-planar coordination environment defined by two pyrimidine N atoms derived from a chelating 2,2′-bipyrimidine ligand and two mutually cis S atoms from two SCN(−) anions. Both 2,2′-bipyrimidine ligands are almost planar [dihedral angle between the rings = 3.98 (16) and 4.57 (17)°] and also chelate to a potassium ion from their other two N atoms. In the crystal, the K(+) ions inter­act with various S and N atoms of the ligands, forming a three-dimensional polymeric network, in which the shortest K⋯K contacts between the KN(7)S polyhedra are 4.4389 (17) and 4.4966 (18) Å. Intra- and inter­molecular C—H⋯S and C—H⋯N hydrogen bonds are also observed. International Union of Crystallography 2012-04-18 /pmc/articles/PMC3344351/ /pubmed/22590117 http://dx.doi.org/10.1107/S1600536812015383 Text en © Kwang Ha 2012 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Metal-Organic Papers
Ha, Kwang
Dipotassium tetra­kis­(thio­cyanato-κS)palladate(II)–(2,2′-bipyrimidine-κ(2) N (1),N (1′))bis­(thio­cyanato-κS)palladium(II) (1/2)
title Dipotassium tetra­kis­(thio­cyanato-κS)palladate(II)–(2,2′-bipyrimidine-κ(2) N (1),N (1′))bis­(thio­cyanato-κS)palladium(II) (1/2)
title_full Dipotassium tetra­kis­(thio­cyanato-κS)palladate(II)–(2,2′-bipyrimidine-κ(2) N (1),N (1′))bis­(thio­cyanato-κS)palladium(II) (1/2)
title_fullStr Dipotassium tetra­kis­(thio­cyanato-κS)palladate(II)–(2,2′-bipyrimidine-κ(2) N (1),N (1′))bis­(thio­cyanato-κS)palladium(II) (1/2)
title_full_unstemmed Dipotassium tetra­kis­(thio­cyanato-κS)palladate(II)–(2,2′-bipyrimidine-κ(2) N (1),N (1′))bis­(thio­cyanato-κS)palladium(II) (1/2)
title_short Dipotassium tetra­kis­(thio­cyanato-κS)palladate(II)–(2,2′-bipyrimidine-κ(2) N (1),N (1′))bis­(thio­cyanato-κS)palladium(II) (1/2)
title_sort dipotassium tetra­kis­(thio­cyanato-κs)palladate(ii)–(2,2′-bipyrimidine-κ(2) n (1),n (1′))bis­(thio­cyanato-κs)palladium(ii) (1/2)
topic Metal-Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3344351/
https://www.ncbi.nlm.nih.gov/pubmed/22590117
http://dx.doi.org/10.1107/S1600536812015383
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