Information card for entry 7215153

Structure parameters

• Formula: C27 H23 N3 O10 Zn
• Calculated formula: C27 H23 N3 O10 Zn
• Title of publication: Positional isomeric and substituent effect on the assemblies of a series of d10 coordination polymers based upon unsymmetric tricarboxylate acids and nitrogen-containing ligands
• Authors of publication: Liu, Ting; Wang, Suna; Lu, Jing; Dou, Jianmin; Niu, Meiju; Li, Dacheng; Bai, Junfeng
• Journal of publication: CrystEngComm
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 27
• Pages of publication: 5476
• a: 19.507 ± 0.002 Å
• b: 12.5344 ± 0.0009 Å
• c: 11.6931 ± 0.0014 Å
• α: 90°
• β: 115.375 ± 0.01°
• γ: 90°
• Cell volume: 2583.2 ± 0.5 ų
• Cell temperature: 121.5 ± 0.14 K
• Ambient diffraction temperature: 121.5 ± 0.14 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1437
• Residual factor for significantly intense reflections: 0.079
• Weighted residual factors for significantly intense reflections: 0.169
• Weighted residual factors for all reflections included in the refinement: 0.2139
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No