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. 2018 Oct 17;37(22):4224–4241. doi: 10.1021/acs.organomet.8b00539

Figure 17.

Figure 17

SambVca2.0 derived %Vbur and steric maps for the: (a) left side: (i) 29g; (ii) 29h; (iii) 29n; (iv) 29m; (v) 7 S-Phos; (vi) 8 X-Phos, derived palladium complexes of structures derived in silico and calculated with restricted dihedral angles as describe in Figure 15 (left); (b) right side: (i) 29g; (ii) 29h; (iii) 29n; (iv) 29m; (v) 7 S-Phos; (vi) 8 X-Phos, derived palladium complexes of structures derived in silico and calculated without any dihedral restrictions as describe in Figure 15 (right).