Information card for entry 2200485

Structure parameters

• Chemical name: Tris(μ-1,4-benzenedicarboxylate)tetrakis(dimethyl sulfoxide)di-μ~3~-hydroxo-tetrazinc dihydrate
• Formula: C32 H42 O20 S4 Zn4
• Calculated formula: C32 H42 O20 S4 Zn4
• Title of publication: Tris(μ-1,4-benzenedicarboxylate)tetrakis(dimethyl sulfoxide)di-μ~3~-hydroxo-tetrazinc dihydrate
• Authors of publication: Wang, Ruihu; Hong, Maochun; Liang, Yucang; Cao, Rong
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 7
• Pages of publication: m277 - m279
• a: 14.4988 ± 0.0002 Å
• b: 17.1659 ± 0.0001 Å
• c: 18.1536 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4518.16 ± 0.14 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0997
• Residual factor for significantly intense reflections: 0.052
• Weighted residual factors for all reflections included in the refinement: 0.1275
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes