Information card for entry 7159178

Structure parameters

• Formula: C25 H30 F N O2
• Calculated formula: C25 H30 F N O2
• Title of publication: Phenylalanine conjugated supramolecular hydrogels developed from the mafenide and flurbiprofen multidrug for biological applications.
• Authors of publication: Manna, Utsab; Roy, Rajdip; Dutta, Abhishek; Roy, Nabanita
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2023
• Journal volume: 21
• Journal issue: 11
• Pages of publication: 2375 - 2389
• a: 6.3673 ± 0.0013 Å
• b: 16.941 ± 0.003 Å
• c: 19.629 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2117.3 ± 0.7 ų
• Cell temperature: 145 ± 2 K
• Ambient diffraction temperature: 145 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.2053
• Residual factor for significantly intense reflections: 0.1653
• Weighted residual factors for significantly intense reflections: 0.3936
• Weighted residual factors for all reflections included in the refinement: 0.4309
• Goodness-of-fit parameter for all reflections included in the refinement: 1.198
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No