Information card for entry 7118190

Structure parameters

• Formula: C20 H20 Cu N4 O8 S2
• Calculated formula: C20 H20 Cu N4 O8 S2
• Title of publication: Templation of a square grid copper(ii) 4,4'-bipyridine network by a 3D PtS-related Cu(i)-Cu(ii) 4,4'-bipyridine crystal.
• Authors of publication: Abrahams, C. T.; Abrahams, B. F.; Hudson, T. A.; Robson, R.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2016
• Journal volume: 52
• Journal issue: 3
• Pages of publication: 609 - 612
• a: 11.5095 ± 0.0005 Å
• b: 11.5095 ± 0.0005 Å
• c: 15.4286 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2043.8 ± 0.16 ų
• Cell temperature: 240 ± 2 K
• Ambient diffraction temperature: 240 ± 2 K
• Number of distinct elements: 6
• Space group number: 130
• Hermann-Mauguin space group symbol: P 4/n c c
• Hall space group symbol: -P 4a 2ac
• Residual factor for all reflections: 0.0709
• Residual factor for significantly intense reflections: 0.0604
• Weighted residual factors for significantly intense reflections: 0.1602
• Weighted residual factors for all reflections included in the refinement: 0.166
• Goodness-of-fit parameter for all reflections included in the refinement: 1.171
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No