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1 article(s) from Shrestha, Binod Babu

Columnar/herringbone dual crystal packing of pyrenylsumanene and its photophysical properties

Binod Babu Shrestha,
Shuhei Higashibayashi and
Hidehiro Sakurai

Beilstein J. Org. Chem. 2014, 10, 841–847, doi:10.3762/bjoc.10.80

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Graphical Abstract

Figure 1: Columnar packing structures of buckybowls showing (a) unidirectional and (b) opposite structures, i...

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Scheme 1: Synthesis of pyrenylsumanene (1): (a) Sc(OTf)₃ (5 mol %), DIH (100 mol %), CH₂Cl₂, rt, 2.5 h, yield...

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Figure 2: The X-ray crystal structure of 1, showing: (a) top view of the ORTEP drawing with 50% probability, ...

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Figure 3: (a) Absorption spectra of 1, 3 and pyrene in CH₂Cl₂ solution (1.0 × 10⁻⁵ M); (b) emission spectra o...

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Figure 4: Calculated HOMO and LUMO orbitals and HOMO–LUMO gaps (ΔE) for 1, 3 and pyrene (ωB97XD/6-31G(d)).

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Published 11 Apr 2014

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