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Beilstein J. Org. Chem. 2017, 13, 1039–1049, doi:10.3762/bjoc.13.103
Graphical Abstract
Figure 1: Structures of 1–6 and 2a–4a.
Figure 2: Representatives of the theoretical dominant conformers of (4R,6R,αS)-1 ((S)-1a1 and (S)-1b1) and (4R...
Figure 3: Comparison of the experimental ECD spectrum of 1 with the M11/TZVP calculated spectra of (4R,6R,αS)-...
Figure 4: Comparison of the experimental ECD spectrum with the BH&HLYP/TZVP calculated spectra of the mixture...
Figure 5: UPLC analysis of photoreaction products of 2 (around tR = 7.5 min) and 3 (around tR = 11.5 min).
Figure 6: Potential energy surfaces of 2a/3a in the S0, S1, and T1 states, geometries of key points in the su...