Information card for entry 4105650

Structure parameters

• Formula: C32 H28 N2 O12 Zn2
• Calculated formula: C26 H10 N2 O9 Zn2
• Title of publication: Gated Channels in a Honeycomb-like Zinc-Dicarboxylate-Bipyridine Framework with Flexible Alkyl Ether Side Chains
• Authors of publication: Sebastian Henke; Roland A. Fischer
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2011
• Journal volume: 133
• Pages of publication: 2064 - 2067
• a: 14.0138 ± 0.0002 Å
• b: 10.9075 ± 0.0002 Å
• c: 21.7501 ± 0.0004 Å
• α: 90°
• β: 91.524 ± 0.002°
• γ: 90°
• Cell volume: 3323.45 ± 0.1 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0708
• Residual factor for significantly intense reflections: 0.0456
• Weighted residual factors for significantly intense reflections: 0.1331
• Weighted residual factors for all reflections included in the refinement: 0.1394
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No