Efficient Color-Tunable Copper(I) Complexes and Their Applications in Solution-Processed Organic Light-Emitting Diodes

A series of dppnc-and neocuproine-based CuI complexes (dppnc = 7,8-bis(diphenylphosphino)-7,8-dicarbanido- undecaborate) are synthesized and the emission color of these CuI complexes can be tuned from green to deep red via rational modification of the neocuproine ligand structure. The molecular structures of the emissive CuI complexes, Cu(dppnc)-G (green emitting), Cu(dppnc)-Y (yellow emitting), and Cu(dppnc)-R (red emitting), are characterized and their electronic structures and related transition properties are elucidated by photo-physical and computational (density functional theory) studies. The calculation results suggest that thermally activated delayed fluorescence (TADF) is the emission mechanism for these CuI complexes. Efficient solution-processed green-, yellow-, and red-emitting OLEDs are fabricated based on the emissive complexes as the dopants. High external quantum efficiency (EQE) of 15.20% and current efficiency of 48.15 cdA(-1) at 1000 cdm(-2) are achieved in the green-emitting device with Cu(dppnc)-G. A maximum EQE of 10.17 %, CIE coordinates of (0.61, 0.38) and a maximum electroluminescent peak of 631 nm are achieved in the red device based on Cu(dppnc)-R.