Intrinsic barriers in identity SN2 reactions and the periodic table [15]

Journal of the American Chemical Society

Volumn 121, Issue 33, 1999, Pages 7724-7725

  Hoz, Shmaryahu ^a   Basch, Harold ^a   Wolk, Joel L ^a   Hoz, Tova ^a   Rozental, Esther ^a  

^a BAR ILAN UNIVERSITY   (Israel)

Author keywords

[No Author keywords available]

Indexed keywords

CHEMICAL REACTION; ENERGY; GEOMETRY; LETTER; MODEL; THEORY; THERMODYNAMICS;

EID: 0033603890     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja984315e     Document Type: Letter

References (20)

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5. The preliminary results for the intrinsic barrier height were obtained for a smaller set of reactions at the RHF/6-31+G* theory level. They showed the same column dependence described in this paper for the G2(+) level reaction barriers but with higher values, as is to be expected.
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12. 4,5,8
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