Are the local electrophilicity descriptors reliable indicators of global electrophilicity trends?

Journal of Physical Chemistry A

Volumn 109, Issue 20, 2005, Pages 4601-4606

  Roy, Ram Kinkar ^a   Usha, V ^a   Paulovič, Jozef ^b   Hirao, Kimihiko ^b  

^a BIRLA INSTITUTE OF TECHNOLOGY AND SCIENCE   (India)

^b UNIVERSITY OF TOKYO   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

ELECTRIC POTENTIAL; ELECTRIC RESISTANCE; IONIZATION; NUMERICAL METHODS; PROBABILITY DENSITY FUNCTION; REACTION KINETICS;

DENSITY FUNCTIONAL THEORY (DFT); ELECTROPHILIC POWER; ELECTROPHILICITY DESCRIPTORS; INTRAMOLECULAR REACTIVITY;

INDICATORS (CHEMICAL);

EID: 20344394679     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp046505j     Document Type: Article

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