Why are Fluorene-Containing Materials so Versatile? An Electronic Structure Perspective
Igor Novak A C and Branka Kovač B CA Charles Sturt University, PO Box 883, Orange, NSW 2800, Australia.
B Physical Chemistry Department, Ruđer Bošković Institute, HR-10002 Zagreb, Croatia.
C Corresponding authors. Email: inovak@csu.edu.au; bkovac@irb.hr
Australian Journal of Chemistry 61(12) 981-985 https://doi.org/10.1071/CH08328
Submitted: 1 August 2008 Accepted: 10 October 2008 Published: 10 December 2008
Abstract
The HeI/HeII photoelectron spectra of substituted fluorenes (2-aminofluorene, 2,7-dibromofluorene, 2-acetylfluorene, and 9-trimethylsilylfluorene) are reported for the first time. We have observed significant changes in the π-electronic structure of the title molecules on substitution at 2-, 7-, and 9-positions and interpreted them within the theoretical framework of resonance and inductive effects. The substituents attached to fluorene at these positions govern the photophysical behaviour and properties of polymetallaynes that contain the fluorene moiety. The mediated properties include the size of the polymer bandgap, various non-linear optical properties, and the intensity and lifetime of luminescence processes. Our spectral results provide some detailed explanations of substituent influences in the form of, for example, orbital ionization energies, which can be further related to charge-transfer processes present in these metallo-organic polymers.
Acknowledgement
The authors thank the Ministry of Science, Education and Sports of the Republic of Croatia for the financial support through Project 098–0982915–2945.
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