Nickel/zinc-catalyzed decarbonylative addition of anhydrides to alkynes: A DFT study

Journal of Molecular Modeling

Volumn 19, Issue 10, 2013, Pages 4545-4554

  Meng, Qingxi ^a,b   Li, Ming ^a  

^a SOUTHWEST UNIVERSITY   (China)

^b SHANDONG AGRICULTURAL UNIVERSITY   (China)

Author keywords

Alkynes; Anhydrides; Decarbonylative addition; DFT; Nickel catalyst; Reaction mechanism; ZnCl2

Indexed keywords

ALKYNE DERIVATIVE; HYDROGEN; NICKEL; PHTHALIC ANHYDRIDE; ZINC;

ADDITION REACTION; CATALYSIS; CHEMICAL BOND; CHEMICAL STRUCTURE; COMPLEX FORMATION; CONFERENCE PAPER; DENSITY FUNCTIONAL THEORY; ENERGY; GEOMETRY; PRIORITY JOURNAL; REACTION ANALYSIS; SOLVENT EFFECT;

ALKYNES; CATALYSIS; CHLORIDES; COMPUTER SIMULATION; GASES; MODELS, CHEMICAL; MODELS, MOLECULAR; MOLECULAR CONFORMATION; NICKEL; PHTHALIC ANHYDRIDES; QUANTUM THEORY; THERMODYNAMICS; ZINC COMPOUNDS;

EID: 84884985733     PISSN: 16102940     EISSN: 09485023     Source Type: Journal    
DOI: 10.1007/s00894-013-1968-8     Document Type: Conference Paper

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