Information card for entry 7238818

Structure parameters

• Formula: C29 H21 N O4
• Calculated formula: C29 H21 N O4
• Title of publication: FeCl3 catalysed multicomponent divergent synthesis of a library of indeno-fused heterocycles
• Authors of publication: Rana, Sunil; Brown, Mike; Mukhopadhyay, Chhanda
• Journal of publication: RSC Advances
• Year of publication: 2013
• Journal volume: 3
• Journal issue: 10
• Pages of publication: 3291
• a: 8.4764 ± 0.0013 Å
• b: 26.185 ± 0.004 Å
• c: 10.0293 ± 0.0016 Å
• α: 90°
• β: 93.002 ± 0.004°
• γ: 90°
• Cell volume: 2223 ± 0.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0747
• Residual factor for significantly intense reflections: 0.0541
• Weighted residual factors for significantly intense reflections: 0.1302
• Weighted residual factors for all reflections included in the refinement: 0.1445
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No