Information card for entry 7111891

Structure parameters

• Formula: C48 H48 N3 O8
• Calculated formula: C48 H48 N3 O8
• Title of publication: Designing a simple organic salt-based supramolecular topical gel capable of displaying in vivo self-delivery application
• Authors of publication: Joydeb Majumder; Jolly Deb; Mahua Rani Das; Siddhartha Sankar Jana; Parthasarathi Dastidar
• Journal of publication: Chem.Commun.
• Year of publication: 2014
• Journal volume: 50
• Pages of publication: 1671
• a: 23.57 ± 0.004 Å
• b: 4.8479 ± 0.0008 Å
• c: 18.554 ± 0.003 Å
• α: 90°
• β: 90.115 ± 0.009°
• γ: 90°
• Cell volume: 2120.1 ± 0.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.1171
• Residual factor for significantly intense reflections: 0.0571
• Weighted residual factors for significantly intense reflections: 0.1533
• Weighted residual factors for all reflections included in the refinement: 0.2047
• Goodness-of-fit parameter for all reflections included in the refinement: 1.144
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No