Information card for entry 2219716

Structure parameters

• Chemical name: Poly[tetraaqua-μ~4~-bromido-di-μ~2~-bromido-μ~2~-hydroxido-di-μ~3~- isonicotinato-tetra-μ~2~-isonicotinato-tetracopper(I)dithulium(III)]
• Formula: C36 H33 Br3 Cu4 N6 O17 Tm2
• Calculated formula: C36 H33 Br3 Cu4 N6 O17 Tm2
• Title of publication: Poly[tetraaqua-μ~4~-bromido-di-μ~2~-bromido-μ~2~-hydroxido-di-μ~3~-isonicotinato-tetra-μ~2~-isonicotinato-tetracopper(I)dithulium(III)]
• Authors of publication: Wang, Guo-Ming; Li, Zeng-Xin; Zheng, Qing-Hua; Liu, Hui-Luan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 10
• Pages of publication: m1260 - m1261
• a: 19.1815 ± 0.0002 Å
• b: 6.6973 ± 0.0004 Å
• c: 34.7044 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4458.3 ± 0.3 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 7
• Space group number: 63
• Hermann-Mauguin space group symbol: C m c m
• Hall space group symbol: -C 2c 2
• Residual factor for all reflections: 0.0326
• Residual factor for significantly intense reflections: 0.0268
• Weighted residual factors for significantly intense reflections: 0.0612
• Weighted residual factors for all reflections included in the refinement: 0.0641
• Goodness-of-fit parameter for all reflections included in the refinement: 1.108
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes