Information card for entry 7160171

Structure parameters

• Chemical name: c31h27n3o3S
• Formula: C31 H27 N3 O3 S
• Calculated formula: C31 H25 N3 O3 S
• Title of publication: Synthesis of biaryl-based carbazoles via C-H functionalization and exploration of their anticancer activities
• Authors of publication: Kaur, Ramandeep; DILIP, HARITHA; Kirubakaran, Sivapriya; Babu, Srinivasarao Arulananda
• Journal of publication: Organic & Biomolecular Chemistry
• Year of publication: 2024
• a: 8.8101 ± 0.0009 Å
• b: 12.3193 ± 0.0011 Å
• c: 13.1329 ± 0.001 Å
• α: 92.965 ± 0.007°
• β: 109.135 ± 0.008°
• γ: 96.379 ± 0.008°
• Cell volume: 1332.4 ± 0.2 ų
• Cell temperature: 273 K
• Ambient diffraction temperature: 273 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: 0.1261
• Residual factor for significantly intense reflections: 0.0599
• Weighted residual factors for significantly intense reflections: 0.146
• Weighted residual factors for all reflections included in the refinement: 0.198
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No