0000000000393905
AUTHOR
El Hassane Anouar
Growth, single crystal investigation, hirshfeld surface analysis, DFT studies, molecular docking, physico-chemical characterization and, in vitro, antioxidant activity of a novel hybrid complex
Abstract Interaction of the diphosphoric acid (H4P2O7) and organic ligand (3.4-dimethylaniline) with transition metal ions, cobalt (II) chloride leads to the formation of novel stable Co(II)-diphosphate cluster with empirical formula (C8H12N)2[Co(H2P2O7)2(H2O)2].2H2O. The structure of the synthesized material was confirmed by single crystal XRD at 120 K. The crystal was plate and crystallized in the triclinic P 1 ¯ space group with a = 7.5340(4) A, b = 7.5445(4) A, c = 13.6896(8) A, α = 84.215(5)°, β = 76.038(5)°, γ = 74.284(5)°, V = 726.38(7) A3 and Z = 1. Full-matrix least-squares refinement converged at R = 0.035 and Rw = 0.088 for 3636 independent observed reflectio…
CCDC 2059295: Experimental Crystal Structure Determination
Related Article: Yathreb Oueslati, Youness El Bakri, Arto Valkonen, Carlos J. Gómez García, El Hassane Anouar, Wajda Smirani|2021|J.Solid State Chem.|301|122319|doi:10.1016/j.jssc.2021.122319