Information card for entry 7221150

Structure parameters

• Formula: C16 H16 N4 O5 Zn
• Calculated formula: C16 H16 N4 O5 Zn
• Title of publication: Pillared-bilayer zinc(ii)‒organic laminae: pore modification and selective gas adsorption
• Authors of publication: Lee, Li-Wei; Luo, Tzuoo-Tsair; Lo, Sheng-Han; Lee, Gene-Hsiang; Peng, Shie-Ming; Liu, Yen-Hsiang; Lee, Sheng-Long; Lu, Kuang-Lieh
• Journal of publication: CrystEngComm
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 33
• Pages of publication: 6320
• a: 14.521 ± 0.003 Å
• b: 7.7378 ± 0.0015 Å
• c: 15.997 ± 0.003 Å
• α: 90°
• β: 106.4 ± 0.03°
• γ: 90°
• Cell volume: 1724.3 ± 0.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0535
• Residual factor for significantly intense reflections: 0.0424
• Weighted residual factors for significantly intense reflections: 0.0988
• Weighted residual factors for all reflections included in the refinement: 0.1034
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No