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Volumn 13, Issue 1, 2007, Pages 336-345

Nucleophilicities and carbon basicities of pyridines

Author keywords

Carbocations; Intrinsic barriers; Kinetics; Organocatalysis; Pyridines

Indexed keywords

CARBON; RATE CONSTANTS; REACTION KINETICS; CATALYSTS; CHEMICAL COMPOUNDS; ENZYME KINETICS; EQUILIBRIUM CONSTANTS; NUCLEOPHILES;

EID: 33845943843     PISSN: 09476539     EISSN: 15213765     Source Type: Journal    
DOI: 10.1002/chem.200600941     Document Type: Article
Times cited : (125)

References (88)
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    • def is defined here as the deviation of the C-H bond connected to the benzylic reaction center from the plane defined by the two C-C bonds attached to this same center.
    • def is defined here as the deviation of the C-H bond connected to the benzylic reaction center from the plane defined by the two C-C bonds attached to this same center.
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    • The following overall charges of the DMAP moiety in benzhydryl cation adduct 3f have been calculated: RHF/6-31G(d)//MP2(fc)/6-31G(d); +0.568 (Mulliken), +0.663 (NPA); MP2(fc)/6-31G(d)//MP2(fc)/6-31G(d): +0.621 (Mulliken), +0.679 (NPA); MP2(fc)/631+G(d)//MP2(fc)/6-31G(d): +1.159 (Mulliken), +0.676 (NPA): MP2(fc)/6-31G(d,p)//MP2(fc)/6-31G(d): +0.616 (Mulliken), +0.679 (NPA).
    • The following overall charges of the DMAP moiety in benzhydryl cation adduct 3f have been calculated: RHF/6-31G(d)//MP2(fc)/6-31G(d); +0.568 (Mulliken), +0.663 (NPA); MP2(fc)/6-31G(d)//MP2(fc)/6-31G(d): +0.621 (Mulliken), +0.679 (NPA); MP2(fc)/631+G(d)//MP2(fc)/6-31G(d): +1.159 (Mulliken), +0.676 (NPA): MP2(fc)/6-31G(d,p)//MP2(fc)/6-31G(d): +0.616 (Mulliken), +0.679 (NPA).
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* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.