Information card for entry 1560783

Structure parameters

• Formula: C17 H19 N3 O4 Zn
• Calculated formula: C17 H19 N3 O4 Zn
• Title of publication: Nitroaromatic-detecting zinc and cadmium coordination polymers with methyl-substituted aliphatic dicarboxylate and 4,4′-dipyridylamine ligands and diverse topologies
• Authors of publication: Contejean, Zaria I.; LaDuca, Robert L.
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2018
• Journal volume: 266
• Pages of publication: 44 - 53
• a: 15.537 ± 0.003 Å
• b: 10.105 ± 0.003 Å
• c: 11.158 ± 0.003 Å
• α: 90°
• β: 99.111 ± 0.004°
• γ: 90°
• Cell volume: 1729.7 ± 0.8 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173.15 K
• Number of distinct elements: 5
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.0467
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for significantly intense reflections: 0.0942
• Weighted residual factors for all reflections included in the refinement: 0.0972
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No