Information card for entry 4505475

Structure parameters

• Formula: C28 H28 Co2 N2 O14
• Calculated formula: C28 H28 Co2 N2 O14
• SMILES: c12ccccc2C(=O)O[Co]2([OH2])([O]1CC(=O)O2)([n]1ccc(c2cc[n](cc2)[Co]23([OH2])([OH2])OC(=O)c4c(cccc4)[O]2CC(=O)O3)cc1)[OH2]
• Title of publication: Syntheses, Structures Tuned by 4,4′-Bipyridine and Magnetic Properties of a Series of Transition Metal Compounds Containingo-Carboxylphenoxyacetate Acid
• Authors of publication: Chen, Zhi; Gao, Dong-Liang; Diao, Chun-Hua; Liu, Yue; Ren, Jia; Chen, Ji; Zhao, Bin; Shi, Wei; Cheng, Peng
• Journal of publication: Crystal Growth & Design
• Year of publication: 2012
• Journal volume: 12
• Journal issue: 3
• Pages of publication: 1201
• a: 9.7351 ± 0.001 Å
• b: 23.513 ± 0.003 Å
• c: 6.506 ± 0.0008 Å
• α: 90°
• β: 107.709 ± 0.007°
• γ: 90°
• Cell volume: 1418.7 ± 0.3 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: 0.069
• Residual factor for significantly intense reflections: 0.0463
• Weighted residual factors for significantly intense reflections: 0.0866
• Weighted residual factors for all reflections included in the refinement: 0.0933
• Goodness-of-fit parameter for all reflections included in the refinement: 1.14
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No