[(Z)-N-(3-Fluoro-phen-yl)-O-methyl-thio-carbamato-κS](tri-phenyl-phosphane-κP)gold(I): crystal structure, Hirshfeld surface analysis and computational study.

ABSTRACT: The title phosphanegold(I) thiol-ate, C₂₆H₂₂AuFNOPS or [Au(C₈H₇FNOS)(C₁₈H₁₅P)], has the Au^I centre coordinated by phosphane-P [2.2494 (8) Å] and thiol-ate-S [2.3007 (8) Å] atoms to define a close to linear geometry [P-Au-S = 176.10 (3)°]. The thiol-ate ligand is orientated so that the meth-oxy-O atom is directed towards the Au atom, forming an Au⋯O close contact of 2.986 (2) Å. In the crystal, a variety of inter-molecular contacts are discerned with fluoro-benzene-C-H⋯O(meth-oxy) and phenyl-C-H⋯F inter-actions leading to dimeric aggregates. These are assembled into a three-dimensional architecture by phenyl-C-H⋯S(thiol-ate) and phenyl-C-H⋯π(fluorobenzene, phen-yl) inter-actions. Accordingly, the analysis of the ca

SUBMITTER: Yeo CI 

PROVIDER: S-EPMC7405594 | biostudies-literature | 2020 Aug

REPOSITORIES: biostudies-literature