Ab initio MP2 and DFT study of the thermal syn elimination reaction in ethyl formate

Journal of Physical Chemistry A

Volumn 107, Issue 10, 2003, Pages 1651-1654

  Hermida Ramón, Jose M ^a   Rodríguez Otero, Jesús ^a   Cabaleiro Lago, Enrique M ^b  

^a LUND UNIVERSITY   (Sweden)

^b UNIVERSITY OF SANTIAGO DE COMPOSTELA   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

ACTIVATION ENERGY; CHEMICAL BONDS; ORGANIC COMPOUNDS; POLYCARBONATES; PROBABILITY DENSITY FUNCTION;

ETHYL FORMATE; MOLLER-PLESSET PERTURBATION THEORY; THERMAL ELIMINATION REACTION;

CHEMICAL REACTIONS;

EID: 0345382802     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp027509w     Document Type: Article

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