Information card for entry 7235453

Structure parameters

• Formula: C42 H34 N6 O12 Zn2
• Calculated formula: C42 H34 N6 O12 Zn2
• Title of publication: Structures and properties of four coordination polymers constructed from 1,3-bis-(4-pyridyl)-propane and aromatic dicarboxylic acids
• Authors of publication: Xu, Bo; Liang, Qing-Shan; Liu, Lian-Tao; Liu, Qi-Sheng; Li, Cun-Cheng
• Journal of publication: RSC Advances
• Year of publication: 2014
• Journal volume: 4
• Journal issue: 27
• Pages of publication: 13919
• a: 9.5955 ± 0.0003 Å
• b: 14.7243 ± 0.0014 Å
• c: 14.8584 ± 0.0014 Å
• α: 67.778 ± 0.009°
• β: 85.961 ± 0.005°
• γ: 85.587 ± 0.005°
• Cell volume: 1935.7 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1085
• Residual factor for significantly intense reflections: 0.0917
• Weighted residual factors for significantly intense reflections: 0.2294
• Weighted residual factors for all reflections included in the refinement: 0.2519
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No