On the regioselective mechanism of novel rearrangements of 1,6-enynes catalyzed by PtCl2: A DFT study

Journal of Molecular Structure: THEOCHEM

Volumn 717, Issue 1-3, 2005, Pages 21-32

  He, Rong Xing ^a,b   Li, Ming ^b   Li, Xiang Yuan ^a  

^a SICHUAN UNIVERSITY   (China)

^b SOUTHWEST UNIVERSITY   (China)

Author keywords

1,6 enyne; DFT; Mechanism; PtCl2; Rearrangement

Indexed keywords

ALKYNE DERIVATIVE; CHLORIDE; COORDINATION COMPOUND; CYCLOPROPANE DERIVATIVE; HYDROGEN; PLATINUM CHLORIDE; UNCLASSIFIED DRUG;

ARTICLE; CATALYSIS; CHEMICAL BOND; DENSITY FUNCTIONAL THEORY; FORCE; GAS; HEAT; ISOMERIZATION; PHASE TRANSITION; PROTON TRANSPORT; REACTION ANALYSIS; RELIABILITY; THERMODYNAMICS;

EID: 14844309377     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2004.10.067     Document Type: Article

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