Information card for entry 4337425

Structure parameters

• Common name: SNU9
• Formula: C40 H24 N2 O10 Zn2
• Calculated formula: C40 H24 N2 O10 Zn2
• Title of publication: In Situ Observation of Gating Phenomena in the Flexible Porous Coordination Polymer Zn2(BPnDC)2(bpy) (SNU-9) in a Combined Diffraction and Gas Adsorption Experiment.
• Authors of publication: Bon, Volodymyr; Senkovska, Irena; Wallacher, Dirk; Többens, Daniel M; Zizak, Ivo; Feyerherm, Ralf; Mueller, Uwe; Kaskel, Stefan
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 3
• Pages of publication: 1513 - 1520
• a: 21.15 ± 0.004 Å
• b: 18.85 ± 0.004 Å
• c: 26.2 ± 0.005 Å
• α: 90°
• β: 102.9 ± 0.03°
• γ: 90°
• Cell volume: 10182 ± 4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• 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: 0.074
• Residual factor for significantly intense reflections: 0.0724
• Weighted residual factors for significantly intense reflections: 0.2126
• Weighted residual factors for all reflections included in the refinement: 0.2172
• Goodness-of-fit parameter for all reflections included in the refinement: 1.144
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.88561 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No