Information card for entry 4514323

Structure parameters

• Formula: C25 H18 N6 O2
• Calculated formula: C25 H18 N6 O2
• Title of publication: Supramolecular Hydrogel Derived from A C3-symmetric Boronic acid Derivative for Stimuli Responsive Release of Insulin and Doxorubicin.
• Authors of publication: Sarkar, Koushik; Dastidar, Parthasarathi
• Journal of publication: Langmuir : the ACS journal of surfaces and colloids
• Year of publication: 2017
• a: 19.795 ± 0.007 Å
• b: 5.3123 ± 0.0019 Å
• c: 22.606 ± 0.008 Å
• α: 90°
• β: 106.332 ± 0.008°
• γ: 90°
• Cell volume: 2281.3 ± 1.4 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120.01 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.161
• Residual factor for significantly intense reflections: 0.0802
• Weighted residual factors for significantly intense reflections: 0.1777
• Weighted residual factors for all reflections included in the refinement: 0.2362
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No