Information card for entry 2215772

Structure parameters

• Chemical name: Poly[aqua(μ~2~-4,4'-bipyridyl-κ^2^<i>N</i>:<i>N</i>')(μ~2~-3-\ phosphonatobenzenesulfonato-κ^2^<i>O</i>:<i>O</i>')copper(II)]
• Formula: C16 H15 Cu N2 O7 P S
• Calculated formula: C16 H15 Cu N2 O7 P S
• Title of publication: Poly[aqua(μ~2~-4,4'-bipyridyl-κ^2^<i>N</i>:<i>N</i>')(μ~2~-3-phosphonatobenzenesulfonato-κ^2^<i>O</i>:<i>O</i>')copper(II)]
• Authors of publication: Du, Zi-Yi; Xie, Yong-Rong; Wen, He-Rui
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 11
• Pages of publication: m2766 - m2767
• a: 10.9824 ± 0.0002 Å
• b: 11.2924 ± 0.0003 Å
• c: 15.1189 ± 0.0003 Å
• α: 90°
• β: 110.331 ± 0.001°
• γ: 90°
• Cell volume: 1758.2 ± 0.07 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0814
• Residual factor for significantly intense reflections: 0.0465
• Weighted residual factors for significantly intense reflections: 0.092
• Weighted residual factors for all reflections included in the refinement: 0.1055
• Goodness-of-fit parameter for all reflections included in the refinement: 1.09
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes