Information card for entry 7110336

Structure parameters

• Formula: C21 H12 N3 O10 S Zn
• Calculated formula: C21 H12 N3 O10 S Zn
• Title of publication: Highly proton conductive nanoporous coordination polymers with sulfonic acid groups on the pore surface
• Authors of publication: Padmini Ramaswamy; Ryotaro Matsuda; Wataru Kosaka; George Akiyama; Hyung Joon Jeon; Susumu Kitagawa
• Journal of publication: Chem.Commun.
• Year of publication: 2014
• Journal volume: 50
• Pages of publication: 1144
• a: 9.642 ± 0.004 Å
• b: 16.575 ± 0.008 Å
• c: 19.66 ± 0.009 Å
• α: 90°
• β: 90.784 ± 0.006°
• γ: 90°
• Cell volume: 3142 ± 2 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 6
• 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: 0.0955
• Residual factor for significantly intense reflections: 0.0846
• Weighted residual factors for significantly intense reflections: 0.2229
• Weighted residual factors for all reflections included in the refinement: 0.2384
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No