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. 2017 Feb 17;15(2):43. doi: 10.3390/md15020043

Figure 5.

Figure 5

Comparison of the measured ECD spectrum of 4 with B3LYP/TZVP calculated spectra of (S)- and (R)-4 in MeOH (σ = 0.20 eV, shift = −18 nm).