Information card for entry 4514610

Structure parameters

• Formula: C25 H29 N O8
• Calculated formula: C25 H29 N O8
• Title of publication: Systematic Diversity-Oriented Synthesis of Reduced Flavones from γ-Pyrones to Probe Biological Performance Diversity.
• Authors of publication: Gerlach, Erica M.; Korkmaz, Melissa A.; Pavlinov, Ivan; Gao, Qiwen; Aldrich, Leslie N.
• Journal of publication: ACS chemical biology
• Year of publication: 2019
• Journal volume: 14
• Journal issue: 7
• Pages of publication: 1536 - 1545
• a: 6.072 Å
• b: 13.299 Å
• c: 16.147 Å
• α: 73.2°
• β: 82.66°
• γ: 78.95°
• Cell volume: 1221.46 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.1885
• Residual factor for significantly intense reflections: 0.1087
• Weighted residual factors for significantly intense reflections: 0.2489
• Weighted residual factors for all reflections included in the refinement: 0.2746
• Goodness-of-fit parameter for all reflections included in the refinement: 1.558
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No