Information card for entry 7223550

Structure parameters

• Formula: C60 H52 Co3 N6 O16
• Calculated formula: C60 H52 Co3 N6 O16
• Title of publication: Exploring biphenyl-2,4,4′-tricarboxylic acid as a flexible building block for the hydrothermal self-assembly of diverse metal‒organic and supramolecular networks
• Authors of publication: Shao, Yong-Liang; Cui, Yan-Hui; Gu, Jin-Zhong; Wu, Jiang; Wang, Ya-Wen; Kirillov, Alexander M.
• Journal of publication: CrystEngComm
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 5
• Pages of publication: 765
• a: 20.6 ± 0.005 Å
• b: 10.4271 ± 0.0011 Å
• c: 29.646 ± 0.005 Å
• α: 90°
• β: 113.51 ± 0.02°
• γ: 90°
• Cell volume: 5839 ± 2 ų
• Cell temperature: 297.16 ± 0.1 K
• Ambient diffraction temperature: 297.16 ± 0.1 K
• Number of distinct elements: 5
• 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: 0.1608
• Residual factor for significantly intense reflections: 0.0829
• Weighted residual factors for significantly intense reflections: 0.168
• Weighted residual factors for all reflections included in the refinement: 0.2278
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No