Information card for entry 2018942

Structure parameters

• Chemical name: Tetrakis(μ-3,4-dimethoxy-<i>trans</i>-cinnamato-κ^2^<i>O</i>:<i>O</i>')bis[[4-(1<i>H</i>-pyrazol-3-yl)pyridine]zinc(II)] heptahydrate
• Formula: C60 H72 N6 O23 Zn2
• Calculated formula: C60 H72 N6 O23 Zn2
• Title of publication: Binuclear and chain-structure zinc(II) complexes constructed from 3,4-dimethoxy-<i>trans</i>-cinnamic acid and <i>N</i>-donor coligands 4-(1<i>H</i>-pyrazol-3-yl)pyridine and 4,4'-bipyridine
• Authors of publication: Wang, Yi-Long; Shao, Zhu-Jia; Qian, Shao-Song
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 5
• Pages of publication: 471 - 475
• a: 25.1037 ± 0.0008 Å
• b: 17.2675 ± 0.0008 Å
• c: 14.9338 ± 0.0006 Å
• α: 90°
• β: 90.042 ± 0.002°
• γ: 90°
• Cell volume: 6473.5 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.0524
• Residual factor for significantly intense reflections: 0.0408
• Weighted residual factors for significantly intense reflections: 0.108
• Weighted residual factors for all reflections included in the refinement: 0.1162
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes