Information card for entry 2239176

Structure parameters

• Chemical name: 5-Chloro-5''-[4-(dimethylamino)benzylidene]-4'-[4-(dimethylamino)phenyl]-1',1''-dimethyldispiro[indoline-3,2'-pyrrolidine-3',3''-piperidine]-2,4''-dione
• Formula: C34 H38 Cl N5 O2
• Calculated formula: C34 H38 Cl N5 O2
• SMILES: Clc1ccc2NC(=O)[C@@]3(N(C[C@@H]([C@@]43CN(CC(=C\c3ccc(N(C)C)cc3)/C4=O)C)c3ccc(N(C)C)cc3)C)c2c1.Clc1ccc2NC(=O)[C@]3(N(C[C@H]([C@]43CN(CC(=C\c3ccc(N(C)C)cc3)/C4=O)C)c3ccc(N(C)C)cc3)C)c2c1
• Title of publication: 5-Chloro-5''-[4-(dimethylamino)benzylidene]-4'-[4-(dimethylamino)phenyl]-1',1''-dimethyldispiro[indoline-3,2'-pyrrolidine-3',3''-piperidine]-2,4''-dione
• Authors of publication: Farag, I. S. Ahmed; Girgis, Adel S.; Ramadan, A. A.; Moustafa, A. M.; Tiekink, Edward R. T.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 1
• Pages of publication: o70 - o71
• a: 11.5458 ± 0.0005 Å
• b: 12.2357 ± 0.0005 Å
• c: 12.5267 ± 0.0007 Å
• α: 64.341 ± 0.002°
• β: 84.286 ± 0.002°
• γ: 83.467 ± 0.002°
• Cell volume: 1582.29 ± 0.13 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2651
• Residual factor for significantly intense reflections: 0.0606
• Weighted residual factors for significantly intense reflections: 0.109
• Weighted residual factors for all reflections included in the refinement: 0.1654
• Goodness-of-fit parameter for all reflections included in the refinement: 0.906
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes