Information card for entry 7125417

Structure parameters

• Formula: C66 H40 N2 O12 Zn3
• Calculated formula: C66 H40 N2 O12 Zn3
• Title of publication: A fivefold linker length reduction in an interpenetrated metal-organic framework via sequential solvent-assisted linker exchange.
• Authors of publication: Cao, Li-Hui; Liu, Xin; Tang, Xiao-Han; Liu, Junyi; Xu, Xiao-Qian; Zang, Shuang-Quan; Ma, Yang-Min
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2019
• Journal volume: 55
• Journal issue: 84
• Pages of publication: 12671 - 12674
• a: 31.8382 ± 0.0004 Å
• b: 28.3102 ± 0.0003 Å
• c: 19.3354 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 17427.9 ± 0.4 ų
• Cell temperature: 200 ± 0.1 K
• Ambient diffraction temperature: 200 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 50
• Hermann-Mauguin space group symbol: P b a n :2
• Hall space group symbol: -P 2ab 2b
• Residual factor for all reflections: 0.139
• Residual factor for significantly intense reflections: 0.1247
• Weighted residual factors for significantly intense reflections: 0.45
• Weighted residual factors for all reflections included in the refinement: 0.47
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No