Information card for entry 2311355

Structure parameters

• Chemical name: Poly[[aqua(μ-2,3-dihydrothieno[3,4-<i>b</i>][1,4]dioxine-5,7-dicarboxylato-κ^2^<i>O</i>^5^:<i>O</i>^7^)[μ-di(pyridin-4-yl)sulfane-κ^2^<i>N</i>:<i>N</i>']zinc] 0.26-hydrate]
• Formula: C18 H14.524 N2 O7.262 S2 Zn
• Calculated formula: C18 H14 N2 O7.262 S2 Zn
• Title of publication: Crystal structure of poly[[aqua-(μ-2,3-di-hydro-thieno[3,4-<i>b</i>][1,4]dioxine-5,7-di-carboxyl-ato-κ²<i>O</i>⁵:<i>O</i>⁷)[μ-di(pyridin-4-yl)sulfane-κ²<i>N</i>:<i>N</i>']zinc] 0.26-hydrate].
• Authors of publication: Wu, Wen-Liang; Hu, Bing
• Journal of publication: Acta crystallographica. Section E, Crystallographic communications
• Year of publication: 2017
• Journal volume: 73
• Journal issue: Pt 3
• Pages of publication: 375 - 377
• a: 10.0052 ± 0.0006 Å
• b: 10.2173 ± 0.0005 Å
• c: 10.6694 ± 0.0005 Å
• α: 87.515 ± 0.004°
• β: 68.625 ± 0.005°
• γ: 73.988 ± 0.005°
• Cell volume: 974.27 ± 0.1 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0342
• Residual factor for significantly intense reflections: 0.0298
• Weighted residual factors for significantly intense reflections: 0.0672
• Weighted residual factors for all reflections included in the refinement: 0.0694
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No