Information card for entry 4514606

Structure parameters

• Formula: C25 H21 F3 N2 O2
• Calculated formula: C25 H21 F3 N2 O2
• Title of publication: Supramolecular Gels Derived from Simple Organic Salts of Flufenamic Acid: Design, Synthesis, Structures, and Plausible Biomedical Application
• Authors of publication: Parveen, Rumana; Jayamma, Bandi; Dastidar, Parthasarathi
• Journal of publication: ACS Biomaterials Science & Engineering
• Year of publication: 2019
• Journal volume: 5
• Journal issue: 5
• Pages of publication: 2180
• a: 6.96 ± 0.004 Å
• b: 10.566 ± 0.007 Å
• c: 14.887 ± 0.009 Å
• α: 82.157 ± 0.01°
• β: 78.009 ± 0.008°
• γ: 88.874 ± 0.008°
• Cell volume: 1060.8 ± 1.1 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120.01 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: 0.1097
• Residual factor for significantly intense reflections: 0.0514
• Weighted residual factors for significantly intense reflections: 0.1327
• Weighted residual factors for all reflections included in the refinement: 0.1939
• Goodness-of-fit parameter for all reflections included in the refinement: 0.946
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No