Multinuclear magnetic resonance studies of fluoronitroanilines.
Ten fluoronitroanilines have been synthesized and the (1)H, (13)C, (15)N and, (19)F NMR spectra of these compounds have been recorded and fully assigned. Density functional theory(DFT) calculations have been performed for all compounds studied. Experimental and theoretical results are compared and the structure and atom character influence on the accuracy of the calculation discussed.
Gierczyk
Błazej
B
Faculty of Chemistry, Adam Mickiewicz University, Grunwaldzka 6, 60-780 Poznań, Poland. hanuman@amu.edu.pl
Nowak-Wydra
Barbara
B
Mielcarek
Aleksandra
A
Zalas
Maciej
M
Grajewski
Jakub
J
D000814:Aniline Compounds / Q000737:chemistry*; D005459:Fluorides / Q000737:chemistry*; D008958:Models, Molecular; D019906:Nuclear Magnetic Resonance, Biomolecular / Q000379:methods*
D000814:Aniline Compounds; C008625:nitroaniline; D005459:Fluorides