Information card for entry 4002149

Structure parameters

• Formula: C27 H23 N7 O Zn
• Calculated formula: C27 H23 N7 O Zn
• Title of publication: Water-Stable Metal‒Organic Frameworks for Fast and High Dichromate Trapping via Single-Crystal-to-Single-Crystal Ion Exchange
• Authors of publication: Fu, Hong-Ru; Xu, Zhong-Xuan; Zhang, Jian
• Journal of publication: Chemistry of Materials
• Year of publication: 2015
• Journal volume: 27
• Journal issue: 1
• Pages of publication: 205
• a: 28.4095 ± 0.0012 Å
• b: 28.0922 ± 0.0011 Å
• c: 9.4743 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 7561.3 ± 0.6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.1057
• Residual factor for significantly intense reflections: 0.0805
• Weighted residual factors for significantly intense reflections: 0.2377
• Weighted residual factors for all reflections included in the refinement: 0.2657
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No