Study on reaction of N-methyl-2-pyrrolidinone with carbon disulfide using density functional theory

Huagong Xuebao/Journal of Chemical Industry and Engineering (China)

Volumn 55, Issue 4, 2004, Pages 569-574

  Wang, Baojun ^a   Wei, Xianyong ^b   Xie, Kechang ^a  

^a TAIYUAN UNIVERSITY OF TECHNOLOGY   (China)

^b CHINA UNIVERSITY OF MINING AND TECHNOLOGY   (China)

Author keywords

Activation energy; Carbon disulfide; Density functional theory; Mechanism; N methyl 2 pyrrolidinone; Rate constant; Transition state

Indexed keywords

ACTIVATION ENERGY; CARBON DISULFIDE; MECHANISMS; QUANTUM THEORY; RATE CONSTANTS;

DENSITY FUNCTIONAL THEORY; N METHYL PYRROLIDINONE; TRANSITION STATE;

REACTION KINETICS;

EID: 3142571047     PISSN: 04381157     EISSN: None     Source Type: Journal    
DOI: None     Document Type: Article

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