Information card for entry 2224714

Structure parameters

• Chemical name: <i>catena</i>-Poly[[diaquazinc(II)]-μ~3~-2,2'-dihydroxy-1,1'-binaphthyl-3,3'- dicarboxylato-κ^3^<i>O</i>:<i>O</i>':<i>O</i>'']
• Formula: C22 H16 O8 Zn
• Calculated formula: C22 H16 O8 Zn
• SMILES: [Zn]123(OC(=O)c4cc5ccccc5c(c4O)c4c5ccccc5cc(C(=[O][Zn](OC(=O)c5cc6ccccc6c(c5O)c5c6ccccc6cc(C(=[O]2)O[Zn]2([O]=C(O3)c3cc6c(c(c7c8c(cc(C(=O)O[Zn]([OH2])([OH2])OC(=O)c9cc%10c(c(c%11c%12c(cc(C(=O)O2)c%11O)cccc%12)c9O)cccc%10)c7O)cccc8)c3O)cccc6)([OH2])[OH2])c5O)([OH2])[OH2])O1)c4O)([OH2])[OH2]
• Title of publication: <i>catena</i>-Poly[[diaquazinc(II)]-μ~3~-2,2'-dihydroxy-1,1'-binaphthyl-3,3'-dicarboxylato-κ^3^<i>O</i>:<i>O</i>':<i>O</i>'']
• Authors of publication: Zhang, Ling-Yun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 1
• Pages of publication: m23
• a: 15.4581 ± 0.0019 Å
• b: 9.5876 ± 0.001 Å
• c: 13.4453 ± 0.0014 Å
• α: 90°
• β: 90.047 ± 0.004°
• γ: 90°
• Cell volume: 1992.7 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• 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: 0.0648
• Residual factor for significantly intense reflections: 0.0452
• Weighted residual factors for significantly intense reflections: 0.1081
• Weighted residual factors for all reflections included in the refinement: 0.1176
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes