Figure 10
The ∇2ρ(r) contour plot of the mean-squared S—C—C—Au plane of the isolated equilibrium PAJDOV (top) and PAJDIP (bottom) structures (negative values are given by red dashed lines). The green dots and red dots denote (3, −1) and (3, +1) CPs of ρ(r), respectively, while the bold dashed lines correspond to bond paths of noncovalent interactions. |