(E)-1-(Benzo[d][1,3]dioxol-5-yl)-3-([2,2′-bithiophen]-5-yl)prop-2-en-1-one: crystal structure, UV–Vis analysis and theoretical studies of a new π-conjugated chalcone

(E)-1-(Benzo[d][1,3]dioxol-5-yl)-3-([2,2′-bithiophen]-5-yl)prop-2-en-1-one: crystal structure, UV–Vis analysis and theoretical studies of a new π-conjugated chalcone

In the title compound, C18H12O3S2, synthesized by the Claisen–Schmidt condensation method, the essentially planar chalcone unit adopts an s-cis configuration with respect to the carbonyl group within the ethylenic bridge. In the crystal, weak C—H...π interactions connect the molecules into zigzag ch...

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Bibliographic Details
Main Authors: Ainizatul Husna Anizaim, Muhamad Fikri Zaini, Muhammad Adlan Laruna, Ibrahim Abdul Razak, Suhana Arshad
Format: Article
Language:English
Published: International Union of Crystallography 2019-05-01
Series:Acta Crystallographica Section E: Crystallographic Communications
Subjects:
crystal structure
DFT
UV–Vis
HOMO–LUMO
Hirshfeld surface
Online Access:http://scripts.iucr.org/cgi-bin/paper?S2056989019004912

Internet

http://scripts.iucr.org/cgi-bin/paper?S2056989019004912

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