Information card for entry 4308470

Structure parameters

• Formula: C22 H18 Ag2 F6 N2 O8 S2
• Calculated formula: C22 H18 Ag2 F6 N2 O8 S2
• SMILES: [Ag]1([O]=C(C(F)(F)F)O[Ag]([O]=C(C(F)(F)F)O1)C#[N]CS(=O)(=O)c1ccc(C)cc1)C#[N]CS(=O)(=O)c1ccc(C)cc1
• Title of publication: A Cyclic Hexamer of Silver Trifluoroacetate Supported by Four Triphenylphosphine Sulfide Template Molecules
• Authors of publication: Bratislav Djordjevic; Oliver Schuster; Hubert Schmidbaur
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 673 - 676
• a: 10.9501 ± 0.0003 Å
• b: 11.2398 ± 0.0004 Å
• c: 13.8195 ± 0.0004 Å
• α: 104.235 ± 0.0018°
• β: 96.633 ± 0.002°
• γ: 118.964 ± 0.0012°
• Cell volume: 1386.14 ± 0.08 ų
• Cell temperature: 143 ± 2 K
• Ambient diffraction temperature: 143 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0353
• Residual factor for significantly intense reflections: 0.0297
• Weighted residual factors for significantly intense reflections: 0.0634
• Weighted residual factors for all reflections included in the refinement: 0.0656
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No