Information card for entry 7251803

Structure parameters

• Formula: C20 H24 Cl2 F4 N6 O8 Zr
• Calculated formula: C20 H24 Cl2 F4 N6 O8 Zr
• Title of publication: Substituent Effects in the Crystallization of Zr−Hydroxamate Metal−Organic Frameworks
• Authors of publication: Liu, Yuxin; Shao, Zhen-Wu; Duan, Xiangping; Xiong, Chaozhi; Li, Xiaoting; Liu, Chong
• Journal of publication: CrystEngComm
• Year of publication: 2026
• a: 23.2456 ± 0.0012 Å
• b: 23.2456 ± 0.0012 Å
• c: 16.2338 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 7596.8 ± 0.8 ų
• Cell temperature: 200 K
• Ambient diffraction temperature: 200 K
• Number of distinct elements: 7
• Space group number: 165
• Hermann-Mauguin space group symbol: P -3 c 1
• Hall space group symbol: -P 3 2"c
• Residual factor for all reflections: 0.0559
• Residual factor for significantly intense reflections: 0.0466
• Weighted residual factors for significantly intense reflections: 0.1313
• Weighted residual factors for all reflections included in the refinement: 0.1372
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No