Beyond DP4: an Improved Probability for the Stereochemical Assignment of Isomeric Compounds using Quantum Chemical Calculations of NMR Shifts

Grimblat, Nicolás ; Zanardi, María M ; Sarotti, Ariel M

Journal of organic chemistry, 2015-12, Vol.80 (24), p.12526-12534 [Periódico revisado por pares]

United States: American Chemical Society

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