Information card for entry 4002150

Structure parameters

• Formula: C54 H41 Cr2 N14 O8 Zn2
• Calculated formula: C54 H41 Cr2 N14 O8 Zn2
• 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: 35.157 ± 0.008 Å
• b: 29.716 ± 0.006 Å
• c: 16.278 ± 0.004 Å
• α: 90°
• β: 109.757 ± 0.004°
• γ: 90°
• Cell volume: 16005 ± 6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1286
• Residual factor for significantly intense reflections: 0.1085
• Weighted residual factors for significantly intense reflections: 0.3157
• Weighted residual factors for all reflections included in the refinement: 0.3348
• Goodness-of-fit parameter for all reflections included in the refinement: 1.175
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No