Skip to main content
. 2023 May 10;28(10):4006. doi: 10.3390/molecules28104006

Figure 5.

Figure 5

Graphical representation of differences in partial atomic charges compared to MULL(solv*) for 5-t2 (top) and 6-t2 (bottom). Charge differences are indicated as a color gradient from blue (δq=0.2e) to red (δq=+0.4e). The differential dipole moment Δμ is displayed as an orange arrow. The magnitude Δμ=Δμ and the angle ΘSQM between the dipole moment of the respective charge distribution with that of the MULL(solv*) reference distribution are given below each structure.