Synergistic strategies to unveil the dual influence of additive and annealing treatment on the morphology of isatin-derived low bandgap small molecule donor in solution-processed organic solar cells

A novel organic small molecule, 5-(4-(diphenylamino)phenyl)-1-octylindoline-2,3-dione (TPI) containing an alkyl chain substituted electron accepting isatin (indoline-2,3-dione) and strong electron withdrawing N, N-diphenylaniline units have been synthesized through Suzuki coupling reaction. The molecular structure of TPI is confirmed by NMR, FT-IR, and Mass spectroscopy techniques. The TPI molecule exhibits a low band gap of approximately ∼ 2.03 eV which is also supported by the DFT results. The influence of additive and heat treatment on the electronic, morphological, and photovoltaic performance of organic solar cells was investigated meticulously. The TPI donor exhibits complementary light absorption with fullerene acceptor in combination with DIO and TA which efficiently absorb the photon in the 300–730 nm range. The TPI was later used as an electron donor material for the fabrication of organic solar cells. Remarkably, the morphology-dependent optimized TPI:PC₇₁BM (1:3.0) exposed excellent power conversion efficiency (PCE) of about ∼ 5.56 % with enhanced V_OC of ∼ 0.811 V, J_SC of 11.81 mA cm⁻² and FF of 55.3 % fabricated in addition with DIO and thermal annealing treatment. Most importantly, the unencapsulated devices maintained > 96 % of the initial PCE value after 240 h under ambient temperature. Our findings indicate that isatin-derived small molecules with simple architecture propose great potential for promising BHJ-OSCs material.