Acta Crystallographica Section C

Crystal Structure Communications

Volume 60, Part 6 (June 2004)



HTML versionpdf versioncif file3d viewstructure factorssimilar papers buy article online

bm1565 scheme

Acta Cryst. (2004). C60, o427-o430    [doi:10.1107/S0108270104008224]

Exo Diels-Alder adducts between ortho- and para-N-acetoxyphenylmaleimides and furan

J. G. Trujillo-Ferrara, E. V. García-Báez, I. I. Padilla-Martínez, F. J. Martínez-Martínez and N. Farfan-García

Abstract: In exo-2-(3,5-dioxo-10-oxa-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)phenyl acetate, C16H13NO5, the plane of the acetoxy group lies almost perpendicular to that of the phenyl ring [dihedral angle = 89.8  (1)°], in contrast with the smaller deviations found in the para isomer exo-4-(3,5-dioxo-10-oxa-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl)phenyl acetate, C16H13NO5, these being 63.6  (1) and 37.0  (1)° for the two crystallographically independent molecules. Irrespective of the position of the acetoxy group, both compounds pack through soft C-H...X (X is O or phenyl) interactions, forming interlinked centrosymmetric tetramers in the bc plane.

Formula: Two isomers of C16H13NO5

Online 22 May 2004


hkldisplay filedownload file

Structure factor file (CIF format) (145.4 kbytes)
Contains datablock I


hkldisplay filedownload file

Structure factor file (CIF format) (265.7 kbytes)
Contains datablock II


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.


Copyright © International Union of Crystallography
IUCr Webmaster