Information card for entry 4504329

Structure parameters

• Formula: C13 H12 N O6.5 Zn
• Calculated formula: C13 H12 N O6.5 Zn
• Title of publication: Ligand and pH-Controlled ZnIIBilayer Coordination Polymers Based on Biphenyl-3,3‘,4,4‘-tetracarboxylate
• Authors of publication: Wang, Ji-Jiang; Gou, Lei; Hu, Huai-Ming; Han, Zhong-Xi; Li, Dong-Sheng; Xue, Gang-Lin; Yang, Meng-Lin; Shi, Qi-Zhen
• Journal of publication: Crystal Growth & Design
• Year of publication: 2007
• Journal volume: 7
• Journal issue: 8
• Pages of publication: 1514
• a: 13.3835 ± 0.001 Å
• b: 6.9617 ± 0.0005 Å
• c: 15.6162 ± 0.0011 Å
• α: 90°
• β: 110.193 ± 0.001°
• γ: 90°
• Cell volume: 1365.56 ± 0.17 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.0398
• Residual factor for significantly intense reflections: 0.0296
• Weighted residual factors for significantly intense reflections: 0.0702
• Weighted residual factors for all reflections included in the refinement: 0.0767
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No