Photoactivatable Oligoelectrolytes Engendering Pyroptotic Vesicles (IMAGE)
Caption
(A) Non-Covalent Interaction (NCI) analysis of NDI-COE. Blue indicates hydrogen bond, green indicates van der Waals (vdW)
interaction, and red indicates steric repulsion, respectively. (B) Bond length and binding site between NDI-COE and water. (C) Calculated Raman spectral comparison of NDI-COE in the presence of water. (D) NCI analysis of Ben-COE. (E) Bond length and binding site between Ben-COE and water. (F) Calculated Raman spectral comparison of Ben-COE in the presence of water. Energy level diagram and photophysical processes of (G) Ben-COE and (H) NDI-COE. In 3G, S0 : neutral molecule in the singlet ground state D0 : ground state doublet of the anion formed after accepting one electron. AEA: adiabatic electron affinity. (I) Ground state and excited state redox potentials (V vs NHE) were calculated by DFT using the polarizable continuum model (PCM) with water as a solvent. (J) Ground state and excited state redox potentials (Eₒₓ, Eᵣₑd, Eₒₓ*, Eᵣₑd*; V vs NHE) and Frontier orbital energies (HOMO, LUMO; eV) of NDI-COE and Ben-COE, calculated by DFT using PCM with water as a solvent.
Credit
J. Am. Chem. Soc. 2026, 148, 5, 5419–5435
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