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. 2019 Aug 26;9:12335. doi: 10.1038/s41598-019-48584-5

Figure 5.

Figure 5

X-ray crystal and calculated structures of 1, 2, 4, and 5. Ellipsoids are drawn at 50% probability level. Hydrogen atoms bound to carbon atoms and solvent are omitted for clarity. The structures were calculated on B3LYP/SDD, 6–31 G(d,p). No imaginary frequencies were found.