Information card for entry 2235589

Structure parameters

• Chemical name: 1'-Methyl-4'-(4-methylphenyl)dispiro[indane-2,3'-pyrrolidine-2',3''- indoline]-1,2''-dione
• Formula: C27 H24 N2 O2
• Calculated formula: C27 H24 N2 O2
• SMILES: O=C1Nc2ccccc2[C@]21N(C[C@H]([C@@]12C(=O)c2ccccc2C1)c1ccc(cc1)C)C.O=C1Nc2ccccc2[C@@]21N(C[C@@H]([C@]12C(=O)c2ccccc2C1)c1ccc(cc1)C)C
• Title of publication: 1'-Methyl-4'-(4-methylphenyl)dispiro[indane-2,3'-pyrrolidine-2',3''-indoline]-1,2''-dione
• Authors of publication: Moustafa, A. M.; Girgis, Adel S.; Shalaby, S. M.; Tiekink, Edward R. T.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 7
• Pages of publication: o2197 - o2198
• a: 6.2414 ± 0.0002 Å
• b: 11.3954 ± 0.0005 Å
• c: 15.5563 ± 0.0007 Å
• α: 78.386 ± 0.002°
• β: 87.165 ± 0.002°
• γ: 77.046 ± 0.002°
• Cell volume: 1056.17 ± 0.08 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1641
• Residual factor for significantly intense reflections: 0.0617
• Weighted residual factors for significantly intense reflections: 0.1175
• Weighted residual factors for all reflections included in the refinement: 0.154
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes