Information card for entry 2208926

Structure parameters

• Chemical name: catena-Poly[[(2,2'-diquinolyl)zinc(II)]-μ-terephthalato]
• Formula: C26 H16 N2 O4 Zn
• Calculated formula: C26 H16 N2 O4 Zn
• SMILES: [Zn]12([n]3c4c(ccc3c3[n]2c2ccccc2cc3)cccc4)OC(=[O]1)c1ccc(cc1)C(=[O]1)O[Zn]12([n]3c4c(ccc3c3[n]2c2ccccc2cc3)cccc4)OC(=O)c1ccc(cc1)C(=O)O[Zn]12([n]3c4c(ccc3c3[n]2c2ccccc2cc3)cccc4)OC(=[O]1)c1ccc(cc1)C(=[O]1)O[Zn]12([n]3c4c(ccc3c3[n]2c2ccccc2cc3)cccc4)OC(=O)c1ccc(cc1)C(=O)[O-]
• Title of publication: <i>catena</i>-Poly[[(2,2'-diquinolyl)zinc(II)]-μ-terephthalato]
• Authors of publication: Li, Zhao-Hui; Ao, Wen-Jiang; Wang, Xu-Xu; Fu, Xian-Zhi
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 5
• Pages of publication: m1048 - m1050
• a: 9.4805 ± 0.0009 Å
• b: 10.0292 ± 0.0012 Å
• c: 13.2442 ± 0.0006 Å
• α: 69.979 ± 0.003°
• β: 69.134 ± 0.006°
• γ: 68.493 ± 0.002°
• Cell volume: 1061.78 ± 0.17 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1288
• Residual factor for significantly intense reflections: 0.074
• Weighted residual factors for significantly intense reflections: 0.1485
• Weighted residual factors for all reflections included in the refinement: 0.1773
• Goodness-of-fit parameter for all reflections included in the refinement: 1.09
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes