Information card for entry 7037240

Structure parameters

• Formula: C8 H16 Br6 Cu3 O4
• Calculated formula: C8 H16 Br6 Cu3 O4
• Title of publication: Crystal-to-crystal transformation from a chain compound to a layered coordination polymer.
• Authors of publication: Shi, Jinbiao; Zhang, Yan; Zhang, Bin; Zhu, Daoben
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 45
• Journal issue: 1
• Pages of publication: 89 - 92
• a: 7.919 ± 0.005 Å
• b: 12.382 ± 0.007 Å
• c: 9.56 ± 0.006 Å
• α: 90°
• β: 107.177 ± 0.008°
• γ: 90°
• Cell volume: 895.6 ± 0.9 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0413
• Residual factor for significantly intense reflections: 0.0393
• Weighted residual factors for significantly intense reflections: 0.095
• Weighted residual factors for all reflections included in the refinement: 0.0962
• Goodness-of-fit parameter for all reflections included in the refinement: 1.151
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No