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. 2016 Sep 15;2(10):740–747. doi: 10.1021/acscentsci.6b00240

Figure 5.

Figure 5

Energy profiles of the biaryl rotation in [8]CPhen3,9 from scan calculations at the semiempirical PM6 level of theory. The dihedral angle was scanned for 180° rotations in ±10° increments.