Information card for entry 4122061

Structure parameters

• Formula: C472 H396 As22 Cd12 F144 N74 O8 S4
• Calculated formula: C471.25 H396 As17 Cd12 F111.25 N73.5 O6 S3.232
• Title of publication: Cation- and Anion-Exchanges Induce Multiple Distinct Rearrangements within Metallosupramolecular Architectures.
• Authors of publication: Riddell, Imogen A.; Ronson, Tanya K.; Clegg, Jack K.; Wood, Christopher S.; Bilbeisi, Rana A.; Nitschke, Jonathan R.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2014
• Journal volume: 136
• Journal issue: 26
• Pages of publication: 9491 - 9498
• a: 90.44 ± 0.006 Å
• b: 30.343 ± 0.002 Å
• c: 48.451 ± 0.004 Å
• α: 90°
• β: 103.24 ± 0.002°
• γ: 90°
• Cell volume: 129426 ± 16 ų
• Cell temperature: 130 ± 2 K
• Ambient diffraction temperature: 130 ± 2 K
• Number of distinct elements: 8
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1495
• Residual factor for significantly intense reflections: 0.1272
• Weighted residual factors for significantly intense reflections: 0.346
• Weighted residual factors for all reflections included in the refinement: 0.3725
• Goodness-of-fit parameter for all reflections included in the refinement: 1.434
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No