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. 2024 May 24;128(22):4493–4506. doi: 10.1021/acs.jpca.4c02580

Figure 2.

Figure 2

6-Membered ring (6-MR) heteroaromatics investigated herein. For a selection of 5-membered ring (5-MR) heteroaromatics and an analysis of their frontier orbital energies, see the SI (Section S3.7).