Information card for entry 2226490

Structure parameters

• Chemical name: 1-Acetyl-3-[2-(2,3,5,6-tetrafluorophenyl)hydrazin-1-ylidene]indolin-2-one
• Formula: C16 H9 F4 N3 O2
• Calculated formula: C16 H9 F4 N3 O2
• SMILES: Fc1c(N/N=C\2c3ccccc3N(C2=O)C(=O)C)c(F)c(F)cc1F
• Title of publication: 1-Acetyl-3-[2-(2,3,5,6-tetrafluorophenyl)hydrazin-1-ylidene]indolin-2-one
• Authors of publication: Pervez, Humayun; Yaqub, Muhammad; Ahmad, Maqbool; Tahir, M. Nawaz; Akhtar, Robina
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 7
• Pages of publication: o1686
• a: 9.8993 ± 0.0019 Å
• b: 4.774 ± 0.0006 Å
• c: 16.066 ± 0.003 Å
• α: 90°
• β: 104.807 ± 0.008°
• γ: 90°
• Cell volume: 734.1 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.1292
• Residual factor for significantly intense reflections: 0.0455
• Weighted residual factors for significantly intense reflections: 0.0624
• Weighted residual factors for all reflections included in the refinement: 0.0804
• Goodness-of-fit parameter for all reflections included in the refinement: 0.963
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes