Information card for entry 4507793

Structure parameters

• Formula: C101 H156 Cl3 Cu8 I11 N16 O40
• Calculated formula: C101 H156 Cl3 Cu8 I11 N16 O40
• Title of publication: Cuprous Halide Complexes of a Variable Length Ligand: Helices, Cluster Chains, and Nets Containing Large Solvated Channels
• Authors of publication: Gee, William J.; Batten, Stuart R.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2013
• Journal volume: 13
• Journal issue: 6
• Pages of publication: 2335
• a: 13.4834 ± 0.0007 Å
• b: 16.9513 ± 0.001 Å
• c: 19.4949 ± 0.0012 Å
• α: 68.035 ± 0.002°
• β: 73.558 ± 0.002°
• γ: 71.645 ± 0.002°
• Cell volume: 3852.4 ± 0.4 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0909
• Residual factor for significantly intense reflections: 0.0672
• Weighted residual factors for significantly intense reflections: 0.1833
• Weighted residual factors for all reflections included in the refinement: 0.212
• Goodness-of-fit parameter for all reflections included in the refinement: 1.112
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No