In the title compound, C22H21N3O4, the central pyrrolidine ring adopts an envelope conformation with the N atom in the flap position. The indoline ring systems are almost perpendicular to the mean plane of the pyrrolidine ring, making dihedral angles of 86.4 (8) and 83.1 (8)°. The acetate group attached to the pyrrolidine ring assumes an extended conformation. In thecrystal, N—H⋯O hydrogen bonds result in the formation of a C(7) chain running along [100]. The crystal packing also features π–π interactions [centroid–centroid distance = 3.2032 (11) Å].
The title compound, CH7N4
+·C4H3O4
−, is a molecular salt in which the aminoguanidinium cations and fumarate monoanions are close to planar, with maximum deviations of 0.011 (1) and 0.177 (1) Å, respectively. The crystal packing is stabilized by intermolecular N—H⋯O and O—H⋯O hydrogen bonds.
Key indicators: single-crystal X-ray study; T = 293 K; mean (C-C) = 0.002 Å; R factor = 0.041; wR factor = 0.106; data-to-parameter ratio = 16.0.In the title compound, C 28 H 30 N 2 O 2 , the cyclohexene ring system adopts a sofa conformation. The crystal structure is stabilized by C-HÁ Á ÁO interactions between methyl H atoms of the ethyl substituents and the O atoms of carbonyl groups of adjacent molecules, and by an intermolecular carbonylcarbonyl interactions .
ExperimentalCrystal data
Data collectionBruker APEXII CCD area-detector diffractometer Absorption correction: none 11070 measured reflections 2334 independent reflections 1898 reflections with I > 2(I) R int = 0.029
In the title compound, C6H12O5, the cyclohexane ring adopts a chair conformation. The absolute configuration is not defined. However, the relative configuration can be assigned as 1R*,3R*,4S*,S*. In the crystal structure, molecules are linked by strong intermolecular O—H⋯O hydrogen bonds, producing a three-dimensional network.
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