Information card for entry 7109678

Structure parameters

• Formula: C110.95 H82.43 Cd2 Cl4 N15.48 O18 S4
• Calculated formula: C110.952 H82.428 Cd2 Cl4 N15.476 O18 S4
• Title of publication: Steric control of the formation of dinuclear double helicate and dinuclear meso-helicate assemblies
• Authors of publication: David J. Cooke; Jasmine M. Cross; Rebecca V. Fennessy; Lindsay P. Harding; Craig R. Rice; Christopher Slater
• Journal of publication: Chem.Commun.
• Year of publication: 2013
• Journal volume: 49
• Pages of publication: 7785
• a: 21.7 ± 0.0011 Å
• b: 12.4488 ± 0.0006 Å
• c: 22.22 ± 0.0011 Å
• α: 90°
• β: 117.05 ± 0.001°
• γ: 90°
• Cell volume: 5345.9 ± 0.5 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0963
• Residual factor for significantly intense reflections: 0.0546
• Weighted residual factors for significantly intense reflections: 0.1503
• Weighted residual factors for all reflections included in the refinement: 0.1743
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No