Information card for entry 7239586

Structure parameters

• Formula: C42 H36 N6 O21 Zn2
• Calculated formula: C42 H36 N6 O21 Zn2
• Title of publication: Syntheses, structures, and properties of six new coordination polymers constructed from N-heterocyclic multicarboxylic acids
• Authors of publication: Li, Fang-Fang; Zhang, Qin-Qin; Zhao, Yan-Yan; Jiang, Shu-Xin; Shi, Xue-Ying; Cui, Jian-Zhong; Gao, Hong-ling
• Journal of publication: RSC Advances
• Year of publication: 2014
• Journal volume: 4
• Journal issue: 21
• Pages of publication: 10424
• a: 24.516 ± 0.004 Å
• b: 7.3474 ± 0.0013 Å
• c: 23.623 ± 0.004 Å
• α: 90°
• β: 99.65 ± 0.002°
• γ: 90°
• Cell volume: 4195 ± 1.2 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 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: 0.0718
• Residual factor for significantly intense reflections: 0.0538
• Weighted residual factors for significantly intense reflections: 0.1134
• Weighted residual factors for all reflections included in the refinement: 0.1214
• Goodness-of-fit parameter for all reflections included in the refinement: 1.099
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No