Information card for entry 2240942

Structure parameters

• Chemical name: 6-Chloro-5-(2-chloroethyl)-3-(propan-2-ylidene)indolin-2-one
• Formula: C13 H13 Cl2 N O
• Calculated formula: C13 H13 Cl2 N O
• Title of publication: Crystal structure of 6-chloro-5-(2-chloroethyl)-3-(propan-2-ylidene)indolin-2-one
• Authors of publication: Roopashree, K. R.; Meti, Gangadhar Y.; Kamble, Ravindra R.; Devarajegowda, H. C.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2015
• Journal volume: 71
• Journal issue: 8
• Pages of publication: o592 - o593
• a: 8.1079 ± 0.001 Å
• b: 8.8699 ± 0.001 Å
• c: 9.1714 ± 0.0012 Å
• α: 101.136 ± 0.006°
• β: 97.799 ± 0.007°
• γ: 98.783 ± 0.006°
• Cell volume: 630.22 ± 0.14 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0883
• Residual factor for significantly intense reflections: 0.0453
• Weighted residual factors for significantly intense reflections: 0.1332
• Weighted residual factors for all reflections included in the refinement: 0.1615
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes