Information card for entry 7018558

Structure parameters

• Formula: C28 H24 Cu N4 O5 S
• Calculated formula: C28 H24 Cu N4 O5 S
• Title of publication: Dipyridyl β-diketonate complexes and their use as metalloligands in the formation of mixed-metal coordination networks.
• Authors of publication: Burrows, Andrew D.; Mahon, Mary F.; Renouf, Catherine L.; Richardson, Christopher; Warren, Anna J.; Warren, John E.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 14
• Pages of publication: 4153 - 4163
• a: 14.563 ± 0.0004 Å
• b: 11.473 ± 0.0003 Å
• c: 16.377 ± 0.0006 Å
• α: 90°
• β: 100.289 ± 0.001°
• γ: 90°
• Cell volume: 2692.29 ± 0.14 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for all reflections: 0.1238
• Residual factor for significantly intense reflections: 0.0592
• Weighted residual factors for significantly intense reflections: 0.1487
• Weighted residual factors for all reflections included in the refinement: 0.1697
• Goodness-of-fit parameter for all reflections included in the refinement: 0.998
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No