Information card for entry 8107200

Structure parameters

• Formula: C26 H21 Cu N5 O8
• Calculated formula: C26 H21 Cu N5 O8
• Title of publication: The crystal structure of poly[aqua-(μ2-4,4′- bis(imidazolyl)biphenyl-κ2 N:N′)-(μ2-3-nitrobenzene-1,2-dicarboxylato-κ2 O:O′)]copper (II) hydrate, C26H21N5O8Cu
• Authors of publication: Li, Gui-Lian; Liu, Meng-Ni; Du, Gao-Jing; Zhang, Jin-Yuan
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2022
• Journal volume: 237
• Journal issue: 4
• Pages of publication: 725 - 727
• a: 17.2262 ± 0.001 Å
• b: 7.3474 ± 0.0003 Å
• c: 21.1086 ± 0.0011 Å
• α: 90°
• β: 111.498 ± 0.006°
• γ: 90°
• Cell volume: 2485.8 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0787
• Residual factor for significantly intense reflections: 0.0629
• Weighted residual factors for significantly intense reflections: 0.1369
• Weighted residual factors for all reflections included in the refinement: 0.1433
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No