Crystal structure, Hirshfeld surface analysis and DFT studies of (E)-1-(4-bromo­phen­yl)-3-(3-fluoro­phen­yl)prop-2-en-1-one

Zaini, M.F.; Razak, I.A.; Anis, M.Z.; Arshad, S.

doi:10.1107/S2056989018017371

Acta Crystallographica Section E
Acta Crystallographica
Section E CRYSTALLOGRAPHIC COMMUNICATIONS

IUCr IT WDC

home archive editors for authors for readers submit open access

view article

Figure 1
(a) The molecular structure of the title compound with displacement ellipsoids drawn at the 50% probability level and (b) the optimized molecular structure of the title compound generated using the DFT method at the B3LYP/6–311 G++(d,p) level.

CRYSTALLOGRAPHIC
COMMUNICATIONS

ISSN: 2056-9890

Volume 75| Part 1| January 2019| Pages 58-63

https://doi.org/10.1107/S2056989018017371

Open

access

Follow Acta Cryst. E

Search IUCr Journals		doi		Advanced search
Author		volume	page