Information card for entry 2225472

Structure parameters

• Chemical name: 4-Hydroxy-3-(1'-methyl-2-oxo-4'-phenylspiro[indoline-3,2'-pyrrolidine]-3-ylcarbonyl)quinolin-2(1<i>H</i>)-one
• Formula: C28 H23 N3 O4
• Calculated formula: C28 H23 N3 O4
• SMILES: O=C1[C@]2(N(C[C@H]([C@@H]2C(=O)c2c(=O)[nH]c3ccccc3c2O)c2ccccc2)C)c2c(N1)cccc2.O=C1[C@@]2(N(C[C@@H]([C@H]2C(=O)c2c(=O)[nH]c3ccccc3c2O)c2ccccc2)C)c2c(N1)cccc2
• Title of publication: 4-Hydroxy-3-(1'-methyl-2-oxo-4'-phenylspiro[indoline-3,2'-pyrrolidine]-3'-ylcarbonyl)quinolin-2(1<i>H</i>)-one
• Authors of publication: Revathi, K.; Sankaran, M.; Ramesh, P.; Mohan, P. S.; Ponnuswamy, M. N.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 4
• Pages of publication: o952
• a: 9.6918 ± 0.0003 Å
• b: 11.0258 ± 0.0003 Å
• c: 12.9663 ± 0.0004 Å
• α: 69.111 ± 0.001°
• β: 72.044 ± 0.002°
• γ: 66.41 ± 0.001°
• Cell volume: 1163.93 ± 0.06 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: 0.0516
• Residual factor for significantly intense reflections: 0.0404
• Weighted residual factors for significantly intense reflections: 0.1093
• Weighted residual factors for all reflections included in the refinement: 0.1192
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes