Acta Crystallographica Section E

Structure Reports Online

Volume 69, Part 2 (February 2013)


organic compounds



gk2549 scheme

Acta Cryst. (2013). E69, o196    [ doi:10.1107/S1600536812052105 ]

5-Benzoyl-4-(4-fluorophenyl)-3,4-dihydropyrimidin-2(1H)-one

R. Kant, V. K. Gupta, K. Kapoor, D. R. Patil and M. B. Deshmukh

Abstract: In the title molecule, C17H13FN2O2, the 3,4-dihydropyrimidine ring adopts a flattened sofa conformation with the flap atom (which bears the fluorophenyl substituent) deviating from the plane defined by the remaining five ring atoms by 0.281 (2) Å. This plane forms dihedral angles of 85.98 (6) and 60.63 (6)° with the 4-fluorophenyl and benzoyl-phenyl rings, respectively. The dihedral angle between the 4-fluorophenyl group and the benzene ring is 71.78 (6)°. In the crystal, N-H...O hydrogen bonds link molecules into inversion dimers that are further connected by another N-H...O interaction into a two-dimensional supramolecular structure parallel to (101).


htmldisplay filedownload file

Hyper-Text Markup Language (HTML) file
[ doi:10.1107/S1600536812052105/gk2549sup0.html ]
Supplementary materials


cmldisplay filedownload file

Chemical Markup Language (CML) file (5.6 kbytes)
[ doi:10.1107/S1600536812052105/gk2549Isup3.cml ]
Supplementary material


Notes:

To open or display or play some files, you may need to set your browser up to use the appropriate software. See the full list of file types for an explanation of the different file types and their related mime types and, where available links to sites from where the appropriate software may be obtained.

The download button will force most browsers to prompt for a file name to store the data on your hard disk.

Where possible, images are represented by thumbnails.

 bibliographic record in  format

  Find reference:   Volume   Page   
  Search:     From   to      Advanced search

Copyright © International Union of Crystallography
IUCr Webmaster