Information card for entry 7160403

Structure parameters

• Formula: C22 H14 F3 N5 O2
• Calculated formula: C22 H14 F3 N5 O2
• Title of publication: Design, synthesis, and apoptotic evaluation of spiro[indoline-3,3'-pyrazolo[1,2-<i>a</i>]indazole] derivatives <i>via</i> [3 + 2] <i>N</i>,<i>N</i>-cycloaddition.
• Authors of publication: Thrinadh Kumar, Rapeti; Mulani, Sohel C.; Anwar, Shaik; Kottalanka, Ravi K.
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2025
• Journal volume: 23
• Journal issue: 15
• Pages of publication: 3583 - 3589
• a: 10.798 ± 0.003 Å
• b: 11.682 ± 0.004 Å
• c: 16.946 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2137.6 ± 1.1 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.101
• Residual factor for significantly intense reflections: 0.0882
• Weighted residual factors for significantly intense reflections: 0.2741
• Weighted residual factors for all reflections included in the refinement: 0.2903
• Goodness-of-fit parameter for all reflections included in the refinement: 1.234
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No