Information card for entry 7123606

Structure parameters

• Chemical name: FuA_12
• Formula: C30 H59 F N4 O4
• Calculated formula: C30 H59 F N4 O4
• Title of publication: An Easy Access to Topical Gels of an Anti-cancer Prodrug (5-Flurouracil Acetic Acid) for Self-drug-delivery Applications
• Authors of publication: Dastidar, Parthasarathi; Chakraborty, Poulami
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 8.8667 ± 0.0006 Å
• b: 9.0125 ± 0.0006 Å
• c: 20.1479 ± 0.0011 Å
• α: 89.377 ± 0.002°
• β: 80.718 ± 0.002°
• γ: 88.288 ± 0.002°
• Cell volume: 1588.22 ± 0.17 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 99.98 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: 0.0984
• Residual factor for significantly intense reflections: 0.0576
• Weighted residual factors for significantly intense reflections: 0.1432
• Weighted residual factors for all reflections included in the refinement: 0.177
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No