Bis{tris[3-(2-pyridyl)-1H-pyrazole]nickel(II)} dodecamolybdo(V,VI)phosphate hexahydrate

Abstract

Key indicators: single-crystal X-ray study; T = 293 K; mean (C-C) = 0.042 Å; Hatom completeness 78%; disorder in main residue; R factor = 0.053; wR factor = 0.155; data-to-parameter ratio = 12.2. 2+ cation is in a distorted octahedral environment, coordinated by six N atoms from three chelating 3-(2-pyridyl)-1H-pyrazole ligands. In the one-electron reduced heteropolyanion, two O atoms of the central PO 4 group (1 symmetry) are equally disordered about an inversion centre. N-HÁ Á ÁO and O-HÁ Á ÁO hydrogen bonds contribute to the crystal packing. Compared with the isotypic structures, the main difference is related with the M-N bond lengths, whereas all other bond lengths, angles and the hydrogenbonding motifs are very similar. Related literature ExperimentalCrystal data [Ni(C 8

Antitubercular 2-Pyrazolylpyrimidinones: Structure–Activity Relationship and Mode-of-Action Studies

“…Similarly, bidentate iron chelation by the pyrazolylpyrimidinones from the pyrimidinone nitrogen and pyrazole nitrogen as depicted in Figure b may be hypothesized. A single-crystal X-ray structure of the pyrazolylpyridines–Fe complex is reported in the literature which supports this hypothesis. , This aspect of metal chelation by the compounds was considered while planning further SAR exploration and target identification studies with the series.…”

“…A single-crystal X-ray structure of the pyrazolylpyridines–Fe complex is reported in the literature which supports this hypothesis. 8 , 9 This aspect of metal chelation by the compounds was considered while planning further SAR exploration and target identification studies with the series.…”