Information card for entry 7107527

Structure parameters

• Formula: C63 H51 Ag2 Cl2 N13 O12
• Calculated formula: C63 H51 Ag2 Cl2 N13 O12
• Title of publication: A triple helix of double helicates: three hierarchical levels of self-assembly in a single structure
• Authors of publication: Andrew Stephenson; Michael D. Ward
• Journal of publication: Chem.Commun.
• Year of publication: 2012
• Journal volume: 48
• Pages of publication: 3605
• a: 21.508 ± 0.0007 Å
• b: 21.508 ± 0.0007 Å
• c: 25.7514 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 10316.5 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 182
• Hermann-Mauguin space group symbol: P 63 2 2
• Hall space group symbol: P 6c 2c
• Residual factor for all reflections: 0.1012
• Residual factor for significantly intense reflections: 0.0946
• Weighted residual factors for significantly intense reflections: 0.2553
• Weighted residual factors for all reflections included in the refinement: 0.2603
• Goodness-of-fit parameter for all reflections included in the refinement: 1.108
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No