Information card for entry 4345210

Structure parameters

• Formula: C20 H13 N3 O5 Zn
• Calculated formula: C20 H13 N3 O5 Zn
• Title of publication: Improvement of Methane-Framework Interaction by Controlling Pore Size and Functionality of Pillared MOFs.
• Authors of publication: Razavi, Sayed Ali Akbar; Masoomi, Mohammad Yaser; Islamoglu, Timur; Morsali, Ali; Xu, Yan; Hupp, Joseph T.; Farha, Omar K.; Wang, Jun; Junk, Peter C.
• Journal of publication: Inorganic chemistry
• Year of publication: 2017
• a: 12.35 ± 0.003 Å
• b: 26.233 ± 0.005 Å
• c: 15.19 ± 0.003 Å
• α: 90°
• β: 98.69 ± 0.03°
• γ: 90°
• Cell volume: 4864.7 ± 1.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.12
• Residual factor for significantly intense reflections: 0.1024
• Weighted residual factors for significantly intense reflections: 0.2748
• Weighted residual factors for all reflections included in the refinement: 0.2859
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No