Information card for entry 7030131

Structure parameters

• Formula: C26 H24 N2 O10 Zn
• Calculated formula: C26 H24 N2 O10 Zn
• SMILES: c1cccc2c1cc(c1C(=O)O[Zn]3([n]21)([n]1c(C(=O)O3)c(C(=O)OC)cc2ccccc12)([OH]C)[OH]C)C(=O)OC
• Title of publication: Temperature-/solvent-dependent low-dimensional compounds based on quinoline-2,3-dicarboxylic acid: structures and fluorescent properties.
• Authors of publication: Wang, Ming-Fang; Hong, Xu-Jia; Zhan, Qing-Guang; Jin, Hong-Guang; Liu, Yi-Ting; Zheng, Zhi-Peng; Xu, Shi-Hai; Cai, Yue-Peng
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 38
• Pages of publication: 11898 - 11906
• a: 12.984 ± 0.008 Å
• b: 7.731 ± 0.005 Å
• c: 12.571 ± 0.008 Å
• α: 90°
• β: 97.32 ± 0.007°
• γ: 90°
• Cell volume: 1251.6 ± 1.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.1046
• Residual factor for significantly intense reflections: 0.0677
• Weighted residual factors for significantly intense reflections: 0.1368
• Weighted residual factors for all reflections included in the refinement: 0.1542
• Goodness-of-fit parameter for all reflections included in the refinement: 1.093
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No