Information card for entry 1546286

Structure parameters

• Formula: C45 H42 Ag4 F9 I N14 O10 S3
• Calculated formula: C45 H42 Ag4.001 F9 I N14 O10 S3
• Title of publication: Macrocycle-assisted synthesis of non-stoichiometric silver(I) halide electrocatalysts for efficient chlorine evolution reaction
• Authors of publication: Zhang, Qiong-You; He, Xin; Zhao, Liang
• Journal of publication: Chem. Sci.
• Year of publication: 2017
• a: 26.256 ± 0.005 Å
• b: 21.16 ± 0.004 Å
• c: 10.086 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5603.5 ± 1.9 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 8
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.1011
• Residual factor for significantly intense reflections: 0.0835
• Weighted residual factors for significantly intense reflections: 0.1377
• Weighted residual factors for all reflections included in the refinement: 0.1439
• Goodness-of-fit parameter for all reflections included in the refinement: 1.209
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No