Skip to main page content
U.S. flag

An official website of the United States government

Dot gov

The .gov means it’s official.
Federal government websites often end in .gov or .mil. Before sharing sensitive information, make sure you’re on a federal government site.

Https

The site is secure.
The https:// ensures that you are connecting to the official website and that any information you provide is encrypted and transmitted securely.

Access keys NCBI Homepage MyNCBI Homepage Main Content Main Navigation
. 2011 Nov;67(Pt 11):o3092-3.
doi: 10.1107/S1600536811044606. Epub 2011 Oct 29.

4-(2,6-Dibromo-4-fluoro-anilino)pent-3-en-2-one

Gertruida J S Venter  1 , Gideon Steyl, Andreas Roodt
Affiliations

4-(2,6-Dibromo-4-fluoro-anilino)pent-3-en-2-one

Gertruida J S Venter et al. Acta Crystallogr Sect E Struct Rep Online. 2011 Nov.

Abstract

The title enamino-ketone, C(11)H(10)Br(2)FNO, has a roughly planar pentenone chain; the maximum displacement of an atom from the pentenone plane is 0.071 (4) Å. The dihedral angle between the benzene ring and the pentenone unit is 77.2 (1)°. Inter-molecular C-H⋯Br and C-H⋯O inter-actions, as well as an intra-molecular N-H⋯O inter-action, are observed. In both methyl groups, each H atom is disordered equally over two sites.

PubMed Disclaimer

Figures

Fig. 1.
Fig. 1.
Molecular structure of the title compound. Displacement ellipsoids are drawn at the 50% probability displacement level. Hydrogen atoms are shown as spheres of arbitrary radius. Both disorder components are shown.
Fig. 2.
Fig. 2.
Partially filled unit cell illustrating the intra- and intermolecular hydrogen bond interactions (dashed lines) in the title compound. Hydrogen atoms not involved in these interactions have been omitted for clarity.
See this image and copyright information in PMC

References

    1. Altomare, A., Burla, M. C., Camalli, M., Cascarano, G. L., Giacovazzo, C., Guagliardi, A., Moliterni, A. G. G., Polidori, G. & Spagna, R. (1999). J. Appl. Cryst. 32, 115–119.
    1. Brandenburg, K. & Putz, H. (2005). DIAMOND Crystal Impact GbR, Bonn, Germany.
    1. Brink, A., Visser, H. G., Steyl, G. & Roodt, A. (2010). Dalton Trans. 39, 5572–5578. - PubMed
    1. Bruker (2004). SAINT-Plus and SADABS Bruker AXS Inc., Madison, Wisconsin, USA.
    1. Bruker (2005). APEX2 Bruker AXS Inc., Madison, Wisconsin, USA.