Information card for entry 1562041

Structure parameters

• Formula: C38 H28 Br3 Co2 N7 O8
• Calculated formula: C38 H26 Br3 Co2 N7 O8
• Title of publication: Syntheses, crystal structures, and properties of new metal‒5-bromonicotinate coordination polymers
• Authors of publication: Li, Wenjie; Li, Guoting; Lv, Lulu; Zhao, Hong; Wu, Benlai
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2015
• Journal volume: 225
• Pages of publication: 297 - 304
• a: 11.3778 ± 0.0005 Å
• b: 12.2675 ± 0.0007 Å
• c: 15.2299 ± 0.0007 Å
• α: 86.196 ± 0.004°
• β: 72.141 ± 0.004°
• γ: 77.692 ± 0.005°
• Cell volume: 1976.81 ± 0.18 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0849
• Residual factor for significantly intense reflections: 0.0751
• Weighted residual factors for significantly intense reflections: 0.1856
• Weighted residual factors for all reflections included in the refinement: 0.1927
• Goodness-of-fit parameter for all reflections included in the refinement: 1.094
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No