Information card for entry 4134896

Structure parameters

• Formula: C64 H58 Co4 N4 O20
• Calculated formula: C64 H58 Co4 N4 O20
• Title of publication: Metal-Organic Frameworks with Hexakis(4-carboxyphenyl)benzene - Extensions to Reticular Chemistry and Introducing Foldable Nets.
• Authors of publication: Amombo Noa, Francoise M.; Svensson Grape, Erik; Brülls, Steffen M; Cheung, Ocean; Malmberg, Per; Inge, A. Ken; McKenzie, Christine J.; Mårtensson, Jerker; Ohrstrom, Lars
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2020
• a: 29.075 ± 0.006 Å
• b: 16.016 ± 0.004 Å
• c: 13.826 ± 0.003 Å
• α: 90°
• β: 98.39 ± 0.005°
• γ: 90°
• Cell volume: 6369 ± 2 ų
• Cell temperature: 297 ± 2 K
• Ambient diffraction temperature: 297 ± 2 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.2717
• Residual factor for significantly intense reflections: 0.1667
• Weighted residual factors for significantly intense reflections: 0.3598
• Weighted residual factors for all reflections included in the refinement: 0.4025
• Goodness-of-fit parameter for all reflections included in the refinement: 1.107
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No