Information card for entry 4122064

Structure parameters

• Formula: C150 H119 As4.88 F38.62 Fe4 N26 O9.88 S3.12
• Calculated formula: C150 H119 As4.875 F29.25 Fe4 N26 O0.5
• 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: 18.038 ± 0.004 Å
• b: 22.427 ± 0.005 Å
• c: 26.77 ± 0.005 Å
• α: 91.08 ± 0.03°
• β: 108.97 ± 0.03°
• γ: 95.93 ± 0.03°
• Cell volume: 10171 ± 4 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2071
• Residual factor for significantly intense reflections: 0.1402
• Weighted residual factors for significantly intense reflections: 0.3626
• Weighted residual factors for all reflections included in the refinement: 0.3926
• Goodness-of-fit parameter for all reflections included in the refinement: 1.174
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No