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A combined multinuclear solid-state NMR and a density functional theory computational approach, with SIMPSON simulations, is evaluated to determine the four heteronuclear  1  J ( 13 C, 17 O) couplings in naphthalaldehydic acid.

physical chemistry chemical physics/pccp. physical chemistry chemical physics

Measuring multiple17O–13CJ-couplings in naphthalaldehydic acid: a combined solid state NMR and density functional theory approach