Information card for entry 1517680

Structure parameters

• Formula: C39 H36 Ag3 F9 N12 O9.5 S3
• Calculated formula: C39 H36 Ag3 F9 N12 O9.5 S3
• Title of publication: A macrocycle-assisted nanoparticlization process for bulk Ag2S
• Authors of publication: He, Xin; Wang, Yuechao; Gao, Cai-Yan; Jiang, Hong; Zhao, Liang
• Journal of publication: Chem. Sci.
• Year of publication: 2015
• Journal volume: 6
• Journal issue: 1
• Pages of publication: 654
• a: 13.528 ± 0.003 Å
• b: 20.05 ± 0.004 Å
• c: 18.26 ± 0.004 Å
• α: 90°
• β: 107.1 ± 0.03°
• γ: 90°
• Cell volume: 4733.8 ± 1.9 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0599
• Residual factor for significantly intense reflections: 0.0529
• Weighted residual factors for significantly intense reflections: 0.1083
• Weighted residual factors for all reflections included in the refinement: 0.1131
• Goodness-of-fit parameter for all reflections included in the refinement: 1.095
• Diffraction radiation wavelength: 0.710747 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No