Isolation and characterization of a blue coloured three coordinate Cu(I)-radical complex with an S 3 donor set.

Autor: Das S; Department of Chemistry, Indian Institute of Technology Madras, Chennai 600036, India. csdkartik@iitm.ac.in., Suthar S; Department of Chemistry, Indian Institute of Technology Madras, Chennai 600036, India. csdkartik@iitm.ac.in., Francis M; Department of Chemistry, IISER Tirupati, AP, India., Ghosh S; Department of Chemistry, Indian Institute of Technology Madras, Chennai 600036, India. csdkartik@iitm.ac.in., Mondal S; Department of Chemistry, Indian Institute of Technology Madras, Chennai 600036, India. csdkartik@iitm.ac.in., Kumar S; Department of Chemistry, Indian Institute of Technology Madras, Chennai 600036, India. csdkartik@iitm.ac.in., Mondal KC; Department of Chemistry, Indian Institute of Technology Madras, Chennai 600036, India. csdkartik@iitm.ac.in.
Jazyk: angličtina
Zdroj: Chemical communications (Cambridge, England) [Chem Commun (Camb)] 2024 Oct 28. Date of Electronic Publication: 2024 Oct 28.
DOI: 10.1039/d4cc03777d
Abstrakt: A stable three coordinate Cu(I)-radical complex with an S 3 donor set having the general formula of [Cu I (S-NHCH)(SS-NHCS)] (1) was isolated as dark blue needles. Interestingly, this complex possesses a zwitterionic ligand, - S-NHCH + , which is coordinated to the central Cu(I) ion via its S-atom [ - S-NHCH + C4-thiolate functionalized C2-protonated zwitterionic N-hetero cyclic carbene; SS-NHCS˙ - NHC-based dithiolene radical anion]. 1 has been structurally characterized by single-crystal X-ray diffraction, and further characterized by UV-vis, IR, XPS, and EPR spectroscopy. 1 has also been studied by quantum chemical calculations.
Databáze: MEDLINE