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One-bond and long-range coupling constants of substituted 2-cyanopyridines. GIAO/DFT calculations of proton and carbon chemical shifts and coupling constants

Katritzky, Alan R.; Akhmedov, Novruz G.; Güven, Alaattin; Scriven, EFV; Majumder, S; Akhmedova, RG; Hall, CD (Elsevier Science BV, 2006)

The magnitude of one bond and long-range coupling constants ((n)J(HH) and (n)J(CH)) in isomeric cyanopyridines-(1, 2, 3), methyl-(4, 5, 6, 7), 3-ethyl-(8), chloro-(9), 3-bromo-(10), acetyl-(11, 12), 5-ethoxycarbonyl-(13) ...