Masilamani Ganesh, Batchu Harikrishna, Amsallem Dana, Bedi Anjan
Department of Chemistry, SRM Institute of Science and Technology, Kattankulathur, Chennai 603203, India.
Institute of Chemistry, The Hebrew University of Jerusalem, Edmond J. Safra Campus, Jerusalem 91904, Israel.
ACS Omega. 2022 Jul 13;7(29):25874-25880. doi: 10.1021/acsomega.2c03609. eCollection 2022 Jul 26.
We have achieved the first series of -based building blocks, viz., s ( = 1-4), and unraveled a rational design of their π-extension. Sequentially increasing numbers () of the exocyclic π-linkers showed (a) a systematic bathochromic shift in both absorption and emission spectra, (b) selective stabilization of the lowest-unoccupied molecular orbital (LUMO), and (c) unselective changes in the S/S states. To our surprise, the LUMO level of (-3.72 eV) was found to be comparable to that of PCBM.
我们已经制备出了第一系列基于[具体物质]的结构单元,即[物质名称]( = 1 - 4),并阐明了其π-扩展的合理设计。依次增加环外π-连接基团的数量()显示出:(a)吸收光谱和发射光谱均出现系统性的红移;(b)最低未占据分子轨道(LUMO)的选择性稳定;(c)S/S态的非选择性变化。令我们惊讶的是,发现[物质名称]的LUMO能级(-3.72 eV)与PCBM的相当。