conclusion 1.The newly DFT method,MII-L,was used to explore the mechanism of this intramolecular [3+2]cycloaddition reaction,which gives[3.3.0]bicyclic ring systems with two vicinal quaternatry carbon
Gold(Ⅰ)-catalyzed regiodivergent intramolecular hydroarylation of carbon-carbon triple bond was established,tuned by electronic and steric property of ligands coordinated to gold(Ⅰ) center.
Rhodium-catalyzed desymmetrization of cyclohexadienones is an efficient method for the asymmetric synthesis of hydrobenzofurans.The newly reported density Functional theory(DFT)method MN 12-L is used
The mechanism and regioselectivity of the [RhⅢCl2Cp*]2-catalyzed C-H bond functionalization and N-O bond cleavage of quinoline N-oxide with alkynes were studied by using DFT calculations,which suggest
Due to the widespread application of gold species in mitochondrial targeted chemotherapeutics,it is highly desirable to develop efficient detection methods for gold species in mitochondria,which is of