Information card for entry 4501486

Structure parameters

• Common name: Zn2IDSbipy
• Formula: C18 H15 N3 O8 Zn2
• Calculated formula: C18 H15 N3 O8 Zn2
• Title of publication: Nanoporous Amino Acid Derived Material Formed via In-Situ Dimerization of Aspartic Acid
• Authors of publication: Gould, Jamie A.; Bacsa, John; Park, Hyunsoo; Claridge, John B.; Fogg, Andrew M.; Ramanathan, Vaidhyanathan; Warren, John E.; Rosseinsky, Matthew J.
• Journal of publication: Crystal Growth & Design
• Year of publication: 2010
• Journal volume: 10
• Journal issue: 7
• Pages of publication: 2977
• a: 10.0245 ± 0.0004 Å
• b: 10.8912 ± 0.0004 Å
• c: 20.7145 ± 0.0008 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2261.58 ± 0.15 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.1164
• Residual factor for significantly intense reflections: 0.1079
• Weighted residual factors for significantly intense reflections: 0.2707
• Weighted residual factors for all reflections included in the refinement: 0.2832
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.671 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No