fac-Tri-aqua-(1,10-phenanthroline-κ² N,N')(sulfato-κO)cobalt(II): crystal structure, Hirshfeld surface analysis and computational study.

ABSTRACT: The Co^II atom in the title complex, [Co(SO₄)(C₁₂H₈N₂)(H₂O)₃] (or C₁₂H₁₄CoN₂O₇S), is octa-hedrally coordinated within a cis-N₂O₄ donor set defined by the chelating N-donors of the 1,10-phenanthroline ligand, sulfate-O and three aqua-O atoms, the latter occupying an octa-hedral face. In the crystal, supra-molecular layers lying parallel to (110) are sustained by aqua-O-H⋯O(sulfate) hydrogen bonding. The layers stack along the c-axis direction with the closest directional inter-action between them being a weak phenanthroline-C-H⋯O(sulfate) contact. There are four significant types of contact contributing to the calculated Hirshfeld surface: at 4

SUBMITTER: Setifi Z 

PROVIDER: S-EPMC7273987 | biostudies-literature | 2020 Jun

REPOSITORIES: biostudies-literature