Information card for entry 7122271

Structure parameters

• Formula: C7 H8 Cu4 I4 N5
• Calculated formula: C7 H8 Cu4 I4 N5
• 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: 14.8153 ± 0.0012 Å
• b: 14.334 ± 0.0012 Å
• c: 11.4471 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2430.9 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 52
• Hermann-Mauguin space group symbol: P n n a
• Hall space group symbol: -P 2a 2bc
• Residual factor for all reflections: 0.0522
• Residual factor for significantly intense reflections: 0.0369
• Weighted residual factors for significantly intense reflections: 0.1005
• Weighted residual factors for all reflections included in the refinement: 0.1094
• Goodness-of-fit parameter for all reflections included in the refinement: 1.086
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No