Information card for entry 7108768

Structure parameters

• Formula: C93 H85 Ag6 Cl3 F36 N12 O24 P6
• Calculated formula: C92 H84 Ag6 F36 N12 O24 P6
• Title of publication: Anion-driven self-assembly: from discrete cages to infinite polycatenanes step by step
• Authors of publication: Qihui Chen; Feilong Jiang; Daqiang Yuan; Lian Chen; Guangxun Lyu; Maochun Hong
• Journal of publication: Chem.Commun.
• Year of publication: 2013
• Journal volume: 49
• Pages of publication: 719
• a: 32.769 ± 0.009 Å
• b: 44.126 ± 0.012 Å
• c: 24.11 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 34862 ± 16 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 8
• Space group number: 72
• Hermann-Mauguin space group symbol: I b a m
• Hall space group symbol: -I 2 2c
• Residual factor for all reflections: 0.1449
• Residual factor for significantly intense reflections: 0.1053
• Weighted residual factors for significantly intense reflections: 0.2883
• Weighted residual factors for all reflections included in the refinement: 0.3247
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No