Acta Crystallographica Section C

Crystal Structure Communications

Volume 62, Part 1 (January 2006)


organic compounds



sk1887 scheme

Acta Cryst. (2006). C62, o8-o12    [ doi:10.1107/S0108270105037753 ]

Hydrogen-bonded supramolecular structures of three related 4-(5-nitro-2-furyl)-1,4-dihydropyridines

A. Quesada, J. Argüello, J. A. Squella, J. L. Wardell, J. N. Low and C. Glidewell

Abstract: In ethyl 5-cyano-2,6-dimethyl-4-(5-nitro-2-furyl)-1,4-dihydropyridine-3-carboxylate, C15H15N3O5, the molecules are linked into chains by a single N-H...O hydrogen bond. The molecules in diethyl 2,6-dimethyl-4-(5-nitro-2-furyl)-1,4-dihydropyridine-3,5-dicarboxylate, C17H20N2O7, are linked by a combination of one N-H...O hydrogen bond and two C-H...O hydrogen bonds into sheets built from equal numbers of R22(17) and R44(18) rings. In 2,6-dimethyl-4-(5-nitro-2-furyl)-1,4-dihydropyridine-3,5-dicarbonitrile, C13H10N4O3, the molecules are linked by a combination of a three-centre N-H...(O)2 hydrogen bond and two independent two-centre C-H...O hydrogen bonds into complex sheets containing four types of ring.

Formula: C15H15N3O5, C17H20N2O7 and C13H10N4O3


hkldisplay filedownload file

Structure factor file (CIF format) (164.9 kbytes)
[ doi:10.1107/S0108270105037753/sk1887Isup2.hkl ]
Contains datablock I


hkldisplay filedownload file

Structure factor file (CIF format) (191.1 kbytes)
[ doi:10.1107/S0108270105037753/sk1887IIsup3.hkl ]
Contains datablock II


hkldisplay filedownload file

Structure factor file (CIF format) (142.7 kbytes)
[ doi:10.1107/S0108270105037753/sk1887IIIsup4.hkl ]
Contains datablock III


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