Structural and electronic impacts of the axialsSubstitution at the phosphorus center of C(sp3)-bridged P-heterotriangulenes
The structural and electronic properties of the dimethylmethylene-bridged P-heterotriangulene have been systematically modulated by functionalization of its phosphorus center. The optoelectronic properties of the obtained derivatives in solution were characterized by UV/Vis absorption and emission s...
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| Hauptverfasser: | , , , , , , , , , |
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| Dokumenttyp: | Article (Journal) |
| Sprache: | Englisch |
| Veröffentlicht: |
July 8, 2024
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| In: |
European journal of organic chemistry
Year: 2024, Jahrgang: 27, Heft: 26, Pages: 1-6 |
| ISSN: | 1099-0690 |
| DOI: | 10.1002/ejoc.202400368 |
| Online-Zugang: | Verlag, kostenfrei, Volltext: https://doi.org/10.1002/ejoc.202400368 Verlag, kostenfrei, Volltext: https://onlinelibrary.wiley.com/doi/abs/10.1002/ejoc.202400368 |
| Verfasserangaben: | Siegfried Harrer, Johannes D.R. Schühle, Christian Neiß, Marina Günthert, Lena Mittmann, Andrea Reule, Jonas Leitner, Frank Rominger, Andreas Görling, and Milan Kivala |
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| 245 | 1 | 0 | |a Structural and electronic impacts of the axialsSubstitution at the phosphorus center of C(sp3)-bridged P-heterotriangulenes |c Siegfried Harrer, Johannes D.R. Schühle, Christian Neiß, Marina Günthert, Lena Mittmann, Andrea Reule, Jonas Leitner, Frank Rominger, Andreas Görling, and Milan Kivala |
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| 520 | |a The structural and electronic properties of the dimethylmethylene-bridged P-heterotriangulene have been systematically modulated by functionalization of its phosphorus center. The optoelectronic properties of the obtained derivatives in solution were characterized by UV/Vis absorption and emission spectroscopy, cyclic voltammetry and 31P NMR spectroscopy. The solid state structures were analyzed by X-ray crystallography. The experimental results were corroborated by density functional theory calculations which revealed the crucial influence of the axial substitution on the bowl-shaped geometry of the phosphorus-centered polycyclic scaffold, which is proportional to the s-character of the P−X bond. The advantage of the bowl-shaped P-heterotriangulene scaffold was demonstrated by successful co-crystallization with fullerene C60. | ||
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| 650 | 4 | |a bridged triarylphosphines | |
| 650 | 4 | |a density functional theory calculations | |
| 650 | 4 | |a phosphorus heterocycles | |
| 650 | 4 | |a X-ray crystallography | |
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