Information card for entry 4338098

Structure parameters

• Formula: C8 H10 Br3 Cu2 N O2
• Calculated formula: C8 H10 Br3 Cu2 N O2
• Title of publication: Tuning of valence States, bonding types, hierarchical structures, and physical properties in copper/halide/isonicotinate system.
• Authors of publication: Liu, Min-Min; Hou, Juan-Juan; Qi, Zhi-Kai; Duan, Li Na; Ji, Wen-Juan; Han, Cai-Yun; Zhang, Xian-Ming
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 8
• Pages of publication: 4130 - 4143
• a: 7.9345 ± 0.0006 Å
• b: 8.6669 ± 0.0007 Å
• c: 10.4946 ± 0.0008 Å
• α: 88.037 ± 0.002°
• β: 72.826 ± 0.001°
• γ: 77.796 ± 0.001°
• Cell volume: 673.62 ± 0.09 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298.15 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: 0.0874
• Residual factor for significantly intense reflections: 0.0737
• Weighted residual factors for significantly intense reflections: 0.2114
• Weighted residual factors for all reflections included in the refinement: 0.2237
• Goodness-of-fit parameter for all reflections included in the refinement: 1.136
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No