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Volumn 44, Issue 6, 2003, Pages 1313-1316

Primary alkyl fluorides as regioselective alkylating reagents of lithium arene dianions. Easy prediction of regioselectivity by MO calculations on the dianion

Author keywords

[No Author keywords available]

Indexed keywords

ALKYL GROUP; ALKYLATING AGENT; ANION; ANTHRACENE; CHRYSENE; FLUORANTHENE; FLUORIDE; HALIDE; LITHIUM DERIVATIVE; NAPHTHALENE; PHENANTHRENE; POLYCYCLIC AROMATIC HYDROCARBON DERIVATIVE; PYRENE; RADICAL; REAGENT;

EID: 0037415432     PISSN: 00404039     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0040-4039(02)02846-0     Document Type: Article
Times cited : (40)

References (13)
  • 10
    • 84988129057 scopus 로고    scopus 로고
    • Closed shell PM3 calculations on the arene dianion were performed using the MOPAC 97 package: Stewart, J. J. P. J. Comp. Chem. 1989, 10, 209. UHF-PM3 (Gaussian 98W) afforded singlet ground states of comparable coefficients/charges on atoms. Further studies will include UHF calculations
    • Closed shell PM3 calculations on the arene dianion were performed using the MOPAC 97 package: Stewart, J. J. P. J. Comp. Chem. 1989, 10, 209. UHF-PM3 (Gaussian 98W) afforded singlet ground states of comparable coefficients/charges on atoms. Further studies will include UHF calculations.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.