Information card for entry 2231953

Structure parameters

• Common name: Poly[diaquabis(quinoline-3-carboxylato-κ^2^<i>O,O'</i>-υ^2^)strontium(II)]
• Chemical name: <i>catena</i>-Poly[[diaquastrontium]-bis(μ-quinoline-3-carboxylato)]
• Formula: C20 H16 N2 O6 Sr
• Calculated formula: C20 H16 N2 O6 Sr
• SMILES: [Sr]1([OH2])([OH2])([O]=C(c2cc3ccccc3nc2)[O]12)[O]1C(c3cc4ccccc4nc3)=[O][Sr]123([OH2])([OH2])([O]=C(c1cc2ccccc2nc1)O3)OC(c1cc2ccccc2nc1)=[O]
• Title of publication: <i>catena</i>-Poly[[diaquastrontium]-bis(μ-quinoline-3-carboxylato)]
• Authors of publication: Miao, Dong-Liang; Li, Shi-Jie; Song, Wen-Dong; Ma, Xiao-Tian; Li, Xiao-Fei
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 10
• Pages of publication: m1386 - m1387
• a: 16.121 ± 0.003 Å
• b: 15.568 ± 0.003 Å
• c: 7.9607 ± 0.0016 Å
• α: 90°
• β: 97.42 ± 0.03°
• γ: 90°
• Cell volume: 1981.2 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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 all reflections: 0.0674
• Residual factor for significantly intense reflections: 0.0368
• Weighted residual factors for significantly intense reflections: 0.0709
• Weighted residual factors for all reflections included in the refinement: 0.1124
• Goodness-of-fit parameter for all reflections included in the refinement: 1.185
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes