Information card for entry 4305219

Structure parameters

• Formula: C58 H50 Ag2 B2 F8 N10 O4
• Calculated formula: C58 H50 Ag2 B2 F8 N10 O4
• SMILES: [B](F)(F)(F)[F-].[Ag]123[n]4c(C(c5cccc(C6(OC)c7[n]([Ag]8([n]9c(C(c%10cccc(C(OC)(c%11[n]2cccc%11)c2[n]3cccc2)n%10)(OC)c2[n]8cccc2)cccc9)[n]2c6cccc2)cccc7)n5)(OC)c2[n]1cccc2)cccc4.[B](F)(F)(F)[F-]
• Title of publication: Self-Assembly of a Cyclic Metalladecapyridine from the Reaction of 2,6-Bis(bis(2-pyridyl)methoxymethane)pyridine with Silver(I)
• Authors of publication: Jie-Sheng Huang; Jin Xie; Steven C. F. Kui; Guo-Su Fang; Nianyong Zhu; Chi-Ming Che
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 5727 - 5735
• a: 20.63 ± 0.003 Å
• b: 13.018 ± 0.002 Å
• c: 22.149 ± 0.003 Å
• α: 90°
• β: 105.23 ± 0.02°
• γ: 90°
• Cell volume: 5739.5 ± 1.5 ų
• Cell temperature: 301 ± 2 K
• Ambient diffraction temperature: 301 ± 2 K
• Number of distinct elements: 7
• 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: 0.0742
• Residual factor for significantly intense reflections: 0.0445
• Weighted residual factors for significantly intense reflections: 0.1217
• Weighted residual factors for all reflections included in the refinement: 0.1336
• Goodness-of-fit parameter for all reflections included in the refinement: 0.964
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No