Mechanism of the gold(I)-catalyzed rearrangement of alkynyl sulfoxides: A DFT study

Organometallics

Volumn 31, Issue 8, 2012, Pages 3043-3055

  Fang, Ran ^a   Yang, Lizi ^a  

^a LANZHOU UNIVERSITY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

ACTIVATION FREE ENERGY; ALKENYL; ALKYL GROUPS; ALKYNYLS; B3LYP/6-31G; BENZENE RING; CARBENOIDS; CATIONIC GOLD; DENSITY FUNCTIONAL THEORY CALCULATIONS; DEPROTONATION PROCESS; DEPROTONATION/PROTONATION; DFT STUDY; ELECTRON WITHDRAWING GROUP; FRIEDEL-CRAFTS ALKYLATION; HYDROGEN ATOMS; INTRAMOLECULAR REACTIONS; NUCLEOPHILIC ADDITIONS; POLARIZABLE CONTINUUM MODEL; PRESENCE OF WATER; RATE DETERMINING STEP; SOLVENT EFFECTS; TRIPLE BONDS;

ACETYLENE; ADDITION REACTIONS; BENZENE; CATALYSIS; CONTINUUM MECHANICS; DENSITY FUNCTIONAL THEORY; GOLD; GOLD COMPOUNDS; HYDROGEN; NUCLEOPHILES; ORGANIC COMPOUNDS;

CYCLIZATION;

EID: 84860349027     PISSN: 02767333     EISSN: 15206041     Source Type: Journal    
DOI: 10.1021/om201159t     Document Type: Article

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