Information card for entry 2232822

Structure parameters

• Chemical name: Poly[[μ-aqua-triaqua[μ~6~-1,3,4,6-tetrakis(carboxylatomethyl)- 7,8-diphenylglycoluril]dizinc] monohydrate]
• Formula: C24 H28 N4 O15 Zn2
• Calculated formula: C24 H28 N4 O15 Zn2
• Title of publication: Poly[[μ-aqua-triaqua[μ~6~-1,3,4,6-tetrakis(carboxylatomethyl)-7,8-diphenylglycoluril]dizinc] monohydrate]
• Authors of publication: Li, Chuan-Qiang; Qiu, Wen-Ge; He, Hong; Wang, Xiuguang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 12
• Pages of publication: m1818 - m1819
• a: 18.091 ± 0.004 Å
• b: 15.245 ± 0.003 Å
• c: 19.007 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5242.1 ± 1.9 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0681
• Residual factor for significantly intense reflections: 0.06
• Weighted residual factors for significantly intense reflections: 0.1453
• Weighted residual factors for all reflections included in the refinement: 0.1512
• Goodness-of-fit parameter for all reflections included in the refinement: 1.126
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes