Figure 8
The non-covalent interaction (NCI) plots for the dimeric aggregates in (I) sustained by (a) O—H⋯O, (b) O—H⋯S and (c) C—H⋯O interactions (highlighted in boxes) and (d) plot of RDG versus sign(λ2)ρ(r). The gradient cut-off is set at 0.4 and the colour scale is −0.03 < ρ < 0.03 atomic units. |