Acta Crystallographica Section C

Volume 65, Part 9 (September 2009)


organic compounds



dn3121 scheme

Acta Cryst. (2009). C65, o475-o478    [ doi:10.1107/S010827010903193X ]

The diastereoisomers 2-[(S/R)-2-chloro-3-quinolyl]-2-[(R)-1-(4-methoxyphenyl)ethylamino]acetonitrile at 100 K

S. Ladraa, A. Bouraiou, S. Bouacida, T. Roisnel and A. Belfaitah

Abstract: In the structures of the two enantiopure diastereoisomers of the title compound, C20H18ClN3O, which crystallize in different space groups, the molecules are very similar as far as bond distances and angles are concerned, but more substantial differences are observed in some torsion angles. The crystal structures of both molecules can be described as zigzag layers along the c axis. The packing is stabilized by hydrogen-bond interactions of N-H...O, C-H...Cl and C-H...[pi] types for 2-[(R)-2-chloro-3-quinolyl]-2-[(R)-1-(4-methoxyphenyl)ethylamino]acetonitrile, and of N-H...N, C-H...O and C-H...[pi] types for 2-[(S)-2-chloro-3-quinolyl]-2-[(R)-1-(4-methoxyphenyl)ethylamino]acetonitrile, resulting in the formation of two- and three-dimensional networks.

Formula: Two diastereoisomers of C20H18ClN3O


hkldisplay filedownload file

Structure factor file (CIF format) (194.5 kbytes)
[ doi:10.1107/S010827010903193X/dn3121Isup2.hkl ]
Contains datablock I


hkldisplay filedownload file

Structure factor file (CIF format) (185.7 kbytes)
[ doi:10.1107/S010827010903193X/dn3121IIsup3.hkl ]
Contains datablock II


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