Regioselectivity in SNH reactions of nitroquinolines with chloromethyl phenyl sulfone

Liebigs Annales

Volumn , Issue 4, 1996, Pages 641-644

  Grzegozek, Maria ^a   Woźniak, Marian ^a   Van Der Plas, Henk C ^b  

^a CRACOW UNIVERSITY OF TECHNOLOGY   (Poland)

^b WAGENINGEN UNIVERSITY   (Netherlands)

Author keywords

AM1; Calculations; Heats of formation of anionic (phenylsulfonyl)methyl adducts; Nitroquinolines

Indexed keywords

EID: 33749150120     PISSN: 09473440     EISSN: None     Source Type: Journal    
DOI: 10.1002/jlac.199619960426     Document Type: Article

References (14)

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14. To investigate the rotational energy barriers, 24 conformations were generated by a stepwise rotation of 15° around τ. Next, each of these conformations was optimized by using an AM1 method over all internal coordinates except the one which defines the relative orientation of the chain (gradient norm <0.1 kcal/mol/A); P. Kowalski, A. Bojarski, M. Mokrosz, Tetrahedron 1995, 51, 2737-2742.