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Crystal structure of di-chlorido-{4-[(E)-(meth-oxy-imino-?N)meth-yl]-1,3-thia-zol-2-amine-?N (3)}palladium(II).


ABSTRACT: In the title compound, [PdCl2(C5H7N3OS)], the Pd(II) atom adopts a distorted square-planar coordination sphere defined by two N atoms of the bidentate ligand and two Cl atoms. The mean deviation from the coordination plane is 0.029?Å. The methyl group is not coplanar with the plane of the metallacycle [torsion angle C-O-N-C = 20.2?(4)°]. Steric repulsion between the methyl group and atoms of the metallacycle is manifested by shortened intra-molecular H?C contacts of 2.27, 2.38 and 2.64?Å, as compared with the sum of the van der Waals radii of 2.87?Å. The amino group participates via one H atom in the formation of an intra-molecular N-H?Cl hydrogen bond. In the crystal, the other H atom of the amino group links mol-ecules via bifurcated N-H?(Cl,O) hydrogen bonds into chains parallel to [001].

SUBMITTER: Dyakonenko VV 

PROVIDER: S-EPMC4331851 | biostudies-literature | 2015 Jan

REPOSITORIES: biostudies-literature

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Crystal structure of di-chlorido-{4-[(E)-(meth-oxy-imino-κN)meth-yl]-1,3-thia-zol-2-amine-κN (3)}palladium(II).

Dyakonenko Viktorita V VV   Zholob Olga O OO   Orysyk Svitlana I SI   Pekhnyo Vasily I VI  

Acta crystallographica. Section E, Crystallographic communications 20150101 Pt 1


In the title compound, [PdCl2(C5H7N3OS)], the Pd(II) atom adopts a distorted square-planar coordination sphere defined by two N atoms of the bidentate ligand and two Cl atoms. The mean deviation from the coordination plane is 0.029 Å. The methyl group is not coplanar with the plane of the metallacycle [torsion angle C-O-N-C = 20.2 (4)°]. Steric repulsion between the methyl group and atoms of the metallacycle is manifested by shortened intra-molecular H⋯C contacts of 2.27, 2.38 and 2.64 Å, as com  ...[more]

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