Information card for entry 7238817

Structure parameters

• Formula: C31 H25 N O6
• Calculated formula: C33 H27 N O6
• 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: 15.366 ± 0.002 Å
• b: 10.1563 ± 0.0014 Å
• c: 18.42 ± 0.003 Å
• α: 90°
• β: 107.313 ± 0.002°
• γ: 90°
• Cell volume: 2744.4 ± 0.7 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: 0.103
• Residual factor for significantly intense reflections: 0.0621
• Weighted residual factors for significantly intense reflections: 0.1879
• Weighted residual factors for all reflections included in the refinement: 0.2192
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No