Information card for entry 4333311

Structure parameters

• Formula: C12 H12 Co2 N4 O12
• Calculated formula: C12 H12 Co2 N4 O12
• SMILES: C1(=O)c2ccc3C(=O)O[Co]45([n]6c(C(=O)O5)ccc5C(=O)O[Co]([n]65)([n]2[n]34)(O1)([OH2])[OH2])([OH2])[OH2]
• Title of publication: Metal-coordination-directed assembly of binuclear trigonal prisms and three-dimensional hydrogen-bonded networks.
• Authors of publication: Sun, Wei-Wei; Cheng, Ai-Ling; Jia, Qin-Xiang; Gao, En-Qing
• Journal of publication: Inorganic chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 14
• Pages of publication: 5471 - 5473
• a: 13.267 ± 0.003 Å
• b: 8.7549 ± 0.0018 Å
• c: 14.685 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1705.7 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0576
• Residual factor for significantly intense reflections: 0.0327
• Weighted residual factors for significantly intense reflections: 0.0476
• Weighted residual factors for all reflections included in the refinement: 0.0502
• Goodness-of-fit parameter for all reflections included in the refinement: 0.843
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No