Information card for entry 7122272

Structure parameters

• Formula: C40 H56 Cu16 I16 N20 O
• Calculated formula: C40 H56 Cu16 I16 N20 O
• Title of publication: Organic amines as templates: pore imprints with exactly size matching in a series of metal-organic frameworks
• Authors of publication: Zhao, Nian; Yang, Lun; Pan, Qiyun; Han, Juanjuan; Li, Xiang; Liu, Meifeng; Xie, Bo; Wang, Yu; Wang, Xiuzhang; Zhu, Guangshan
• Journal of publication: Chemical Communications
• Year of publication: 2018
• a: 17.84 ± 0.002 Å
• b: 31 ± 0.004 Å
• c: 8.4707 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4684.6 ± 1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 59
• Hermann-Mauguin space group symbol: P m m n
• Hall space group symbol: -P 2ab 2a
• Residual factor for all reflections: 0.0444
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for significantly intense reflections: 0.0842
• Weighted residual factors for all reflections included in the refinement: 0.088
• Goodness-of-fit parameter for all reflections included in the refinement: 1.103
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No