Information card for entry 4509165

Structure parameters

• Formula: C84 H81 Cu5 N10 O36.5
• Calculated formula: C84 H56 Cu5 N10 O36.53
• Title of publication: In Situ Obtained Cu(II) Compound with Coexistence of Polycatenation and Polythreading
• Authors of publication: Cao, Xin-Yi; Lin, Qi-Pu; Qin, Ye-Yan; Zhang, Jian; Li, Zhao-Ji; Cheng, Jian-Kai; Yao, Yuan-Gen
• Journal of publication: Crystal Growth & Design
• Year of publication: 2009
• Journal volume: 9
• Journal issue: 1
• Pages of publication: 20
• a: 11.105 ± 0.003 Å
• b: 19.337 ± 0.005 Å
• c: 20.513 ± 0.005 Å
• α: 90°
• β: 94.632 ± 0.004°
• γ: 90°
• Cell volume: 4391 ± 2 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: 0.1001
• Residual factor for significantly intense reflections: 0.084
• Weighted residual factors for significantly intense reflections: 0.2455
• Weighted residual factors for all reflections included in the refinement: 0.2625
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No