Information card for entry 4332149

Structure parameters

• Formula: C6 H13 Cu3 N9 O8
• Calculated formula: C6 H6 Cu3 N9 O8
• Title of publication: Synthesis and Characterization of a 3D Coordination Polymer Based on Trinuclear Triangular CuIIas Secondary Building Units
• Authors of publication: Ding, Bin; Yi, Long; Cheng, Peng; Liao, Dai-Zheng; Yan, Shi-Ping
• Journal of publication: Inorganic Chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 15
• Pages of publication: 5799 - 5803
• a: 24.644 ± 0.003 Å
• b: 24.644 ± 0.003 Å
• c: 24.644 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 14967 ± 3 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 5
• Space group number: 228
• Hermann-Mauguin space group symbol: F d -3 c :2
• Hall space group symbol: -F 4ud 2vw 3
• Residual factor for all reflections: 0.0433
• Residual factor for significantly intense reflections: 0.0378
• Weighted residual factors for significantly intense reflections: 0.1152
• Weighted residual factors for all reflections included in the refinement: 0.1183
• Goodness-of-fit parameter for all reflections included in the refinement: 1.218
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No