Scandium and lanthanum hydride complexes stabilized by super-bulky penta-arylcyclopentadienyl ligands

Abstract

Hydrogenolysis of the half-sandwich penta-arylcycopentadienyl-supported rare-earth metal dibenzyl complexes [(Cp^Ar5)Ln(p-CH₂-C₆H₄-Me)₂(THF)] (Cp^Ar5 = C₅Ar₅, Ar = 3,5-ⁱPr₂-C₆H₃; Ln = Sc, La) afforded a bimetallic scandium complex [(Cp^Ar5)Sc(H)(μ-OC₄H₉)]₂ (2) with two terminal hydrido ligands, and a double-sandwich bimetallic lanthanum hydride complex [(Cp^Ar5)La(μ-H)]₂ (4) bearing the reduced Cp^Ar5 ligand. DFT calculations were conducted to elucidate the reaction profiles.