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Volumn 65, Issue 22, 2000, Pages 7303-7309

A quantum mechanics/molecular mechanics study of the highly enantioselective addition of diethylzinc to benzaldehyde promoted by (R)-2-piperidino-1,1,2-triphenylethanol

Author keywords

[No Author keywords available]

Indexed keywords

2 PIPERIDINO 1,1,2 TRIPHENYLETHANOL; ALCOHOL DERIVATIVE; BENZALDEHYDE; CARBENE; DIETHYLZINC; PIPERIDINE DERIVATIVE; UNCLASSIFIED DRUG; ZINC;

EID: 0034602444     PISSN: 00223263     EISSN: None     Source Type: Journal    
DOI: 10.1021/jo000928+     Document Type: Article
Times cited : (79)

References (37)
  • 23
    • 0007360299 scopus 로고    scopus 로고
    • The core geometry of these transition states (anti and syn) has been used in combination with AM1 geometrical optimization of substituents as a design tool for ligands derived from 3-phenyl-3-aminopropane-1,2-diol. See ref 3a
  • 26
    • 0007408615 scopus 로고    scopus 로고
    • Note, however, that semiempirical approaches have shown to correctly predict the sign of enantioselectivity when a single ligand is considered. See refs 3a and 12
  • 37
    • 0007359243 scopus 로고    scopus 로고
    • This result should be taken with precaution, since the calculated energy differences between transition states are not δδG values


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.