Information card for entry 7129398

Structure parameters

• Formula: C62 H78 N4 O6 Zn
• Calculated formula: C62 H78 N4 O6 Zn
• Title of publication: Multi-NSAIDs Based Zn(II) Coordination Complex Derived Metallogelators/Metallogels as Plausible Multi-drug Self-delivery Systems
• Authors of publication: Dastidar, Parthasarathi; Biswas, Protap; Datta, Hemanta Kumar
• Journal of publication: Chemical Communications
• Year of publication: 2022
• a: 22.24 ± 0.003 Å
• b: 19.26 ± 0.003 Å
• c: 14.7633 ± 0.0018 Å
• α: 90°
• β: 115.266 ± 0.003°
• γ: 90°
• Cell volume: 5718.8 ± 1.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100.02 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1275
• Residual factor for significantly intense reflections: 0.0595
• Weighted residual factors for significantly intense reflections: 0.1271
• Weighted residual factors for all reflections included in the refinement: 0.1683
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No