Information card for entry 2008110

Structure parameters

• Common name: (ClN2O4)2 - 2AgCF3SO3
• Chemical name: μ-[35,44-dichloro-6,9,23,26,38,41,47,50-octaoxa-3,12,20,29-tetraaza- pentacyclo[29.8^3,12^.8^20,29^.3^1,31^.1^1,31^.1^14,18^]dopentaconta -14,16,18(44),31,33,1(35)-hexene]disilver(I) bis(triflate)
• Formula: C42 H62 Ag2 Cl2 F6 N4 O14 S2
• Calculated formula: C42 H62 Ag2 Cl2 F6 N4 O14 S2
• Title of publication: A cylindrical macrocycle with two diaza-18-crown-6 macrocycles encapsulating two silver cations
• Authors of publication: Plenio, Herbert; Diodone, Ralph
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 1
• Pages of publication: IUC9800081
• a: 11.15 ± 0.002 Å
• b: 9.028 ± 0.002 Å
• c: 25.637 ± 0.005 Å
• α: 90°
• β: 91.37 ± 0.03°
• γ: 90°
• Cell volume: 2579.9 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• 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: 0.038
• Residual factor for significantly intense reflections: 0.028
• Weighted residual factors for all reflections included in the refinement: 0.072
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes