Information card for entry 7124534

Structure parameters

• Formula: C19 H20 Cl Cu3 I2 N3 O6 Sb
• Calculated formula: C19 H20 Cl Cu3 I2 N3 O6 Sb
• Title of publication: New type composite MOFs based on high-valent Sb(V)-based units and cuprous-halide clusters
• Authors of publication: Lin, Li-Dan; Li, Zhong; Liu, Jin-Hua; Sun, Yan-Qiong; Li, Xin-Xiong; Zheng, Shou-Tian
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 12.5861 ± 0.0012 Å
• b: 13.0814 ± 0.0012 Å
• c: 32.104 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5285.7 ± 0.9 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 8
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0439
• Residual factor for significantly intense reflections: 0.0342
• Weighted residual factors for significantly intense reflections: 0.0791
• Weighted residual factors for all reflections included in the refinement: 0.0842
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No