Isomeric dithienophosphepines: the impact of ring fusion on electronic and structural properties

Abstract The synthesis and extensive experimental (X-ray crystallography, UV/Vis spectroscopy, cyclic voltammetry) and theoretical (DFT calculations) characterization of two isomeric dithieno[b,f]phosphepines (DTPs) are presented herein. The relative orientation of the phosphepine and the thiophene...

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Main Authors: Padberg, Kevin (Author) , Ascherl, Johannes D. R. (Author) , Kivala, Milan (Author)
Format: Article (Journal)
Language:English
Published: 2020
In: Chemistry - a European journal
Year: 2019, Volume: 26, Issue: 16, Pages: 3474-3478
ISSN:1521-3765
DOI:10.1002/chem.201905429
Online Access:Verlag, kostenfrei, Volltext: https://doi.org/10.1002/chem.201905429
Verlag, kostenfrei, Volltext: https://chemistry-europe.onlinelibrary.wiley.com/doi/full/10.1002/chem.201905429
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Author Notes:Kevin Padberg, Johannes D.R. Ascherl, Frank Hampel, and Milan Kivala
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Summary:Abstract The synthesis and extensive experimental (X-ray crystallography, UV/Vis spectroscopy, cyclic voltammetry) and theoretical (DFT calculations) characterization of two isomeric dithieno[b,f]phosphepines (DTPs) are presented herein. The relative orientation of the phosphepine and the thiophene moieties has a decisive impact on the electronic and structural properties of these compounds. Moreover, the thiophene units allow for a facile subsequent functionalization through direct Pd-catalyzed C?H coupling, which renders DTPs highly promising building blocks for organophosphorus functional materials.
Item Description:First published: 04 December 2019
Gesehen am 23.04.2020
Physical Description:Online Resource
ISSN:1521-3765
DOI:10.1002/chem.201905429