Information card for entry 7221771

Structure parameters

• Formula: C62 H40 Cu4 N10 O26
• Calculated formula: C62 H40 Cu4 N10 O26
• Title of publication: Solvent-controlled Structural Diversity Observed in Three Cu(II) MOFs with 2,2'-dinitro-biphenyl-4,4'-dicarboxylate Ligand: Synthesis, Structures and Magnetism
• Authors of publication: Zhang, Na; Zhang, Jian-Yong; Jia, qin xiang; Deng, Wei; Gao, En-Qing
• Journal of publication: RSC Adv.
• Year of publication: 2015
• a: 16.6013 ± 0.0006 Å
• b: 13.2647 ± 0.0004 Å
• c: 29.6078 ± 0.0008 Å
• α: 90°
• β: 92.656 ± 0.003°
• γ: 90°
• Cell volume: 6513 ± 0.4 ų
• Cell temperature: 150.01 ± 0.1 K
• Ambient diffraction temperature: 150.01 ± 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: 0.0816
• Residual factor for significantly intense reflections: 0.0745
• Weighted residual factors for significantly intense reflections: 0.2053
• Weighted residual factors for all reflections included in the refinement: 0.2107
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No