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Published in 2023 at "Molecules"
DOI: 10.3390/molecules28031499
Abstract: Attempts at the theoretical interpretation of NMR spectra have a very long and fascinating history. Present quantum chemical calculations of shielding and indirect spin-spin couplings permit modeling NMR spectra when small, isolated molecules are studied.…
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Keywords:
spin coupling;
spin;
shielding spin;
parameters ch4 ... See more keywords