Information card for entry 2022275

Structure parameters

• Chemical name: Poly[[[μ-bis(pyridin-4-yl)amine-κ^2^<i>N</i>:<i>N</i>'](μ-naphthalene-2,6-dicarboxylato-κ^2^<i>O</i>^2^:<i>O</i>^6^)zinc(II)] 0.5-hydrate]
• Formula: C22 H16 N3 O4.5 Zn
• Calculated formula: C22 H16 N3 O4.5 Zn
• Title of publication: Assembly of two novel coordination polymers by selecting ditopic or chelating auxiliary ligands with naphthalene-2,6-dicarboxylic acid: synthesis, structure and luminescence sensing
• Authors of publication: Zuo, Yuxiang; Yang, Jie; Chen, Cheng; Xue, Yun-Shan; Zhang, Jun
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2020
• Journal volume: 76
• Journal issue: 12
• a: 11.0556 ± 0.001 Å
• b: 9.5218 ± 0.0009 Å
• c: 18.2923 ± 0.0017 Å
• α: 90°
• β: 100.732 ± 0.003°
• γ: 90°
• Cell volume: 1891.9 ± 0.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298.42 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0306
• Residual factor for significantly intense reflections: 0.0252
• Weighted residual factors for significantly intense reflections: 0.0608
• Weighted residual factors for all reflections included in the refinement: 0.0629
• 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: No
• Has Fobs: Yes