Information card for entry 7251908

Structure parameters

• Formula: C31 H28 N5 O3
• Calculated formula: C31 H28 N5 O3
• Title of publication: Regioselective Triclocarban-Catalyzed Synthesis of Spiroindeno- and Spirooxindolo-Pyrrolizidines with Apoptosis Induction in MCF-7 Cells
• Authors of publication: Rukyanaik, V.; Pradhan, Samata; Godugu, Chandraiah; Tothadi, Srinu; Rama Krishna, Kadiyam; Pawar, Ravinder; Basavoju, Srinivas
• Journal of publication: RSC Medicinal Chemistry
• Year of publication: 2026
• a: 15.6361 ± 0.0012 Å
• b: 16.2505 ± 0.0011 Å
• c: 10.9406 ± 0.0009 Å
• α: 90°
• β: 108.354 ± 0.003°
• γ: 90°
• Cell volume: 2638.5 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1073
• Residual factor for significantly intense reflections: 0.062
• Weighted residual factors for significantly intense reflections: 0.1544
• Weighted residual factors for all reflections included in the refinement: 0.2101
• Goodness-of-fit parameter for all reflections included in the refinement: 1.131
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No