Literature DB >> 23387523

Tuning the HOMO-LUMO gap of pyrene effectively via donor-acceptor substitution: positions 4,5 versus 9,10.

Lukas Zöphel1, Volker Enkelmann, Klaus Müllen.   

Abstract

Donor and acceptor substituents were introduced at pyrene's K-regions in order to engineer its optoelectronic properties. A study of the influence of the substitution pattern on the frontier orbitals as well as on the molecular packing is provided. A comparison with the pure donor and acceptor substituted pyrene derivatives highlights the strong impact of the presented donor-acceptor substitution.

Entities:  

Year:  2013        PMID： 23387523     DOI： 10.1021/ol303476g

Source DB:  PubMed          Journal:  Org Lett        ISSN： 1523-7052            Impact factor:   6.005


  5 in total

1.  Polycyclic Aromatic Hydrocarbons via Iron(III)-Catalyzed Carbonyl-Olefin Metathesis.

Authors:  Christopher C McAtee; Paul S Riehl; Corinna S Schindler
Journal:  J Am Chem Soc       Date:  2017-02-21       Impact factor: 15.419

2.  Noncovalent Functionalization of 2D Black Phosphorus with Fluorescent Boronic Derivatives of Pyrene for Probing and Modulating the Interaction with Molecular Oxygen.

Authors:  Margherita Bolognesi; Salvatore Moschetto; Mariachiara Trapani; Federico Prescimone; Claudia Ferroni; Gabriele Manca; Andrea Ienco; Silvia Borsacchi; Maria Caporali; Michele Muccini; Maurizio Peruzzini; Manuel Serrano-Ruiz; Lucia Calucci; Maria Angela Castriciano; Stefano Toffanin
Journal:  ACS Appl Mater Interfaces       Date:  2019-06-13       Impact factor: 9.229

3.  Synthesis, Photophysical and Electronic Properties of New Red-to-NIR Emitting Donor-Acceptor Pyrene Derivatives.

Authors:  Julia Merz; Maximilian Dietz; Yvonne Vonhausen; Frederik Wöber; Alexandra Friedrich; Daniel Sieh; Ivo Krummenacher; Holger Braunschweig; Michael Moos; Marco Holzapfel; Christoph Lambert; Todd B Marder
Journal:  Chemistry       Date:  2019-11-19       Impact factor: 5.236

Review 4.  Photoactive organic material discovery with combinatorial supramolecular assembly.

Authors:  Andrew M Levine; Sankarsan Biswas; Adam B Braunschweig
Journal:  Nanoscale Adv       Date:  2019-09-05

5.  0-0 Energies Using Hybrid Schemes: Benchmarks of TD-DFT, CIS(D), ADC(2), CC2, and BSE/GW formalisms for 80 Real-Life Compounds.

Authors:  Denis Jacquemin; Ivan Duchemin; Xavier Blase
Journal:  J Chem Theory Comput       Date:  2015-10-09       Impact factor: 6.006
  5 in total

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