Information card for entry 4329891

Structure parameters

• Formula: C84 H133 Co2 Fe4 N7 O28
• Calculated formula: C84 H133 Co2 Fe4 N7 O28
• Title of publication: Tailoring the Exchange Interaction in Covalently Linked Basic Carboxylate Clusters through Bridging Ligand Selection
• Authors of publication: Pablo Alborés; Christian Plenk; Eva Rentschler
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 8373 - 8384
• a: 13.3788 ± 0.0003 Å
• b: 19.9463 ± 0.0004 Å
• c: 21.3461 ± 0.0005 Å
• α: 71.069 ± 0.001°
• β: 89.505 ± 0.001°
• γ: 78.256 ± 0.001°
• Cell volume: 5265.3 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0549
• Residual factor for significantly intense reflections: 0.0343
• Weighted residual factors for significantly intense reflections: 0.0773
• Weighted residual factors for all reflections included in the refinement: 0.0883
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No