Structureactivity correlation for relative chain initiation to propagation rates in single-site olefin polymerization catalysis

Organometallics

Volumn 31, Issue 2, 2012, Pages 602-618

  Manz, Thomas A ^a,b,c   Caruthers, James M ^a   Sharma, Shalini ^b   Phomphrai, Khamphee ^b,d   Thomson, Kendall T ^a   Nicholas Delgass, W ^a   Abu Omar, Mahdi M ^b  

^a Purdue University   (United States)

^b PURDUE UNIVERSITY   (United States)

^c Georgia Institute of Technology   (United States)

^d MAHIDOL UNIVERSITY   (Thailand)

Author keywords

[No Author keywords available]

Indexed keywords

1-HEXENE; BATCH POLYMERIZATIONS; CHAIN INITIATION; CHEMICAL MECHANISM; DFT CALCULATION; DOCKING SITES; EXPERIMENTAL DATA; GROUP 4; INITIATING GROUPS; ION PAIRING; ION PAIRS; LIGAND COORDINATION; MONOMER CONCENTRATION; MONOMER INSERTION; OLEFIN POLYMERIZATION CATALYSIS; OLEFIN POLYMERIZATION CATALYSTS; OPENING SIZES; PROPAGATION RATE; QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIPS; STRUCTURE-ACTIVITY; TRANSITION STATE; UNDERLYING CAUSE;

CATALYSIS; CATALYSTS; COMPUTATIONAL CHEMISTRY; DENSITY FUNCTIONAL THEORY; OLEFINS; ZIRCONIUM; ZIRCONIUM COMPOUNDS;

POLYMERIZATION;

EID: 84863416783     PISSN: 02767333     EISSN: 15206041     Source Type: Journal    
DOI: 10.1021/om200884x     Document Type: Article

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