Information card for entry 2203041

Structure parameters

• Chemical name: 1-N-methyl-Spiro-[2 -3'] oxindole-spiro-[3-2"] indan-1",3"dione 4-[2"'- chlorophenyl] pyrrolidine
• Formula: C26 H19 Cl N2 O3
• Calculated formula: C26 H19 Cl N2 O3
• SMILES: Clc1cc([C@H]2C3([C@]4(C(=O)Nc5c4cccc5)N(C2)C)C(=O)c2ccccc2C3=O)ccc1.Clc1cc([C@@H]2C3([C@@]4(C(=O)Nc5c4cccc5)N(C2)C)C(=O)c2ccccc2C3=O)ccc1
• Title of publication: 4'-(3-Chlorophenyl)-1-methyl-1<i>H</i>-indole-3-spiro-2'-pyrrolidine-3'-spiro-2''-indan-2,1'',3''-trione
• Authors of publication: P. R. Seshadri; S. Selvanayagam; D. Velmurugan; K. Ravikumar; A. R. Sureshbabu; R. Raghunathan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 1
• Pages of publication: o51 - o53
• a: 7.8394 ± 0.0006 Å
• b: 11.676 ± 0.0009 Å
• c: 11.8628 ± 0.001 Å
• α: 85.657 ± 0.001°
• β: 89.752 ± 0.001°
• γ: 83.726 ± 0.002°
• Cell volume: 1076.22 ± 0.15 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: 0.0751
• Residual factor for significantly intense reflections: 0.0556
• Weighted residual factors for significantly intense reflections: 0.1566
• Weighted residual factors for all reflections included in the refinement: 0.1715
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes