Information card for entry 2201938

Structure parameters

• Formula: C20 H14 N2 O5 Zn
• Calculated formula: C20 H14 N2 O5 Zn
• SMILES: [Zn]12([OH2])(OC(=O)c3[n]1c1c(cc3)cccc1)OC(=O)c1[n]2c2c(cc1)cccc2
• Title of publication: Aquabis(quinoline-2-carboxylato-κ^2^<i>N,O</i>)zinc(II)
• Authors of publication: Okabe, Nobuo; Muranishi, Yasunori
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 5
• Pages of publication: m244 - m246
• a: 7.716 ± 0.004 Å
• b: 7.564 ± 0.006 Å
• c: 30.037 ± 0.003 Å
• α: 90°
• β: 95.97 ± 0.02°
• γ: 90°
• Cell volume: 1743.6 ± 1.7 ų
• Cell temperature: 296.2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.049
• Weighted residual factors for all reflections included in the refinement: 0.1704
• Goodness-of-fit parameter for all reflections included in the refinement: 0.893
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes