RT Journal Article
T1 Selective Functionalization of Arene C(sp2 )−H Bonds by Gold Catalysis: The Role of Carbene Substituents
A1 Pizarro Javier, Juan Diego
A1 Schmidtke, Inga L.
A1 Nova, Ainara
A1 Romero Fructos-Vázquez, Manuel
A1 Pérez Romero, Pedro José
AB The complete regioselective incorporation of carbene units to nonactivated arene rings has been achieved employing gold(I) catalysts bearing alkoxydiaminophosphine ligands, with readily available, nonelaborated ethyl 2-phenyl-diazoacetate as the carbene source. These results are in contrast with the scarce precedents which required highly elaborated diazo substrates. Density functional theory (DFT) calculations have revealed the important role of the R group in the C(R)CO 2Et fragment, which dramatically affects the energy profile of this transformation.
PB American Chemical Society
SN 2155-5435 (electrónico)
YR 2022
FD 2022-05-25
LK https://hdl.handle.net/10272/21352
UL https://hdl.handle.net/10272/21352
LA eng
NO Pizarro, J. D., Schmidtke, I. L., Nova, A., Fructos, M. R., & Pérez, P. J. (2022). Selective Functionalization of Arene C(sp2)–H Bonds by Gold Catalysis: The Role of Carbene Substituents. In ACS Catalysis (Vol. 12, Issue 12, pp. 6851–6856). American Chemical Society (ACS). https://doi.org/10.1021/acscatal.2c01713
NO We thank the Ministerio de Ciencia e Innovación for Grant PID2020-113797RB-C21, also financed by FEDER “Una manera de hacer Europa”. We also thank Junta de Andalucía (P18-RT-1536) and Universidad de Huelva (P.O. Feder UHU-1260216). I.S. and A.N. acknowledge the support from the Research Council of Norway through its FRINATEK (No. 314321), Centre of Excellence schemes (No. 262695), and the Norwegian Metacenter for Computational Science (NOTUR) for computational resources (project number nn4654k).Funding for open access charge: Universidad de Huelva / CBUA
DS Repositorio Institucional de la Universidad de Huelva
RD 1 jun 2026