Information card for entry 4081427

Structure parameters

• Formula: C212 H172 Ag24 F24 N24 O28 S18
• Calculated formula: C212 H172 Ag24 F24 N24 O28 S18
• Title of publication: Silver‒Organic Frameworks Containing Ethynediide or Ethynide with Ancillary Oligo-α-sulfanylpyrazinyl and Dimethylsulfoxide Ligands
• Authors of publication: Wen, Li-Li; Wang, Han; Wan, Chong-Qing; Mak, Thomas C. W.
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 18
• Pages of publication: 5144
• a: 12.7457 ± 0.0012 Å
• b: 16.6712 ± 0.0017 Å
• c: 27.97 ± 0.003 Å
• α: 90°
• β: 95.52 ± 0.002°
• γ: 90°
• Cell volume: 5915.7 ± 1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0645
• Residual factor for significantly intense reflections: 0.056
• Weighted residual factors for significantly intense reflections: 0.1484
• Weighted residual factors for all reflections included in the refinement: 0.1555
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No