Information card for entry 7108769

Structure parameters

• Formula: C46.5 H42.5 Ag3 Cl4.5 N6 O24
• Calculated formula: C46 H42 Ag3 Cl3 N6 O24
• 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: 23.153 ± 0.004 Å
• b: 23.153 ± 0.004 Å
• c: 23.88 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 12801 ± 4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 135
• Hermann-Mauguin space group symbol: P 42/m b c
• Hall space group symbol: -P 4c 2ab
• Residual factor for all reflections: 0.0936
• Residual factor for significantly intense reflections: 0.0843
• Weighted residual factors for significantly intense reflections: 0.2361
• Weighted residual factors for all reflections included in the refinement: 0.2456
• Goodness-of-fit parameter for all reflections included in the refinement: 1.09
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No