Information card for entry 7057197

Structure parameters

• Chemical name: fused Ph-BOD-Ph
• Formula: C26 H26 N4 O
• Calculated formula: C26 H26 N4 O
• Title of publication: Effects of chalcogen atom variation in chalcogenadiazole fused indolo[2,3-a]carbazoles
• Authors of publication: Ghosh, Sirina; Kumar, Neha Rani; Zade, Sanjio S.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2018
• Journal volume: 42
• Journal issue: 9
• Pages of publication: 6889
• a: 8.5102 ± 0.0012 Å
• b: 11.3944 ± 0.0018 Å
• c: 11.7116 ± 0.0019 Å
• α: 97.936 ± 0.013°
• β: 96.991 ± 0.013°
• γ: 110.09 ± 0.014°
• Cell volume: 1038.7 ± 0.3 ų
• Cell temperature: 100.01 ± 0.1 K
• Ambient diffraction temperature: 100.01 ± 0.1 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.115
• Residual factor for significantly intense reflections: 0.096
• Weighted residual factors for significantly intense reflections: 0.2506
• Weighted residual factors for all reflections included in the refinement: 0.2673
• Goodness-of-fit parameter for all reflections included in the refinement: 1.133
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No