Information card for entry 2220718

Structure parameters

• Chemical name: (<i>Z</i>)-3-[(<i>E</i>)-3-Phenylallylidene]indolin-2-one
• Formula: C17 H13 N O
• Calculated formula: C17 H13 N O
• SMILES: O=C1Nc2c(/C1=C/C=C/c1ccccc1)cccc2
• Title of publication: (<i>Z</i>)-3-[(<i>E</i>)-3-Phenylallylidene]indolin-2-one
• Authors of publication: Zhang, Hongming; Akubathini, Shashidhar Kumar; Ankati, Haribabu; Biehl, Ed
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 2
• Pages of publication: o363
• a: 5.8373 ± 0.0004 Å
• b: 15.3294 ± 0.0011 Å
• c: 14.6516 ± 0.001 Å
• α: 90°
• β: 94.312 ± 0.001°
• γ: 90°
• Cell volume: 1307.35 ± 0.16 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.083
• Residual factor for significantly intense reflections: 0.057
• Weighted residual factors for significantly intense reflections: 0.12
• Weighted residual factors for all reflections included in the refinement: 0.132
• Goodness-of-fit parameter for all reflections included in the refinement: 1.113
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes