Information card for entry 7031092

Structure parameters

• Formula: C44 H16 Ag12 F24 N8 O16
• Calculated formula: C44 H16 Ag12 F24 N8 O16
• Title of publication: Silver cages with encapsulated acetylenediide as building blocks for hydrothermal synthesis of supramolecular complexes with n-cyanopyridine and pyridine-n-carboxamide (n=3, 4).
• Authors of publication: Zhao, Xiao-Li; Mak, Thomas C. W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2004
• Journal issue: 20
• Pages of publication: 3212 - 3217
• a: 27.4459 ± 0.0014 Å
• b: 9.2926 ± 0.0005 Å
• c: 27.8251 ± 0.0014 Å
• α: 90°
• β: 117.106 ± 0.001°
• γ: 90°
• Cell volume: 6317.2 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.1047
• Residual factor for significantly intense reflections: 0.077
• Weighted residual factors for significantly intense reflections: 0.1657
• Weighted residual factors for all reflections included in the refinement: 0.1827
• Goodness-of-fit parameter for all reflections included in the refinement: 1.141
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No