Figure 6
(a) Negative electrostatic potentials (in kJ mol−1) show that lactam and syn-amide are more electronegative that N-oxide coformers. (b) Lactam and syn-amide are less electropositive (in kJ mol−1) compared with other coformers. (c) Comparison of the positive and negative electrostatic potential energy. All the structures and energy values are displayed in Fig. S3 and Tables S2 and S3. |