Information card for entry 2007319

Structure parameters

• Common name: Compound Cubpsac
• Formula: C34 H28 Cu N6 O8 S2
• Calculated formula: C34 H28 Cu N6 O8 S2
• SMILES: [Cu]12([n]3ccccc3c3[n]1cccc3)([n]1ccccc1c1[n]2cccc1)N1S(=O)(=O)c2ccccc2C1=O.O.O.O.S1(=O)(=O)c2ccccc2C([O-])=N1
• Title of publication: Structure of Bis(2,2'-bipyridyl)(saccharinato-<i>N</i>)copper(II) Saccharinate Dihydrate. Addendum
• Authors of publication: Grupče, Orhideja; Jovanovski, Gligor; Šoptrajanov, Bojan; Hergold-Brundić, Antonija
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 6
• Pages of publication: 890 - 891
• a: 26.3 ± 0.006 Å
• b: 15.596 ± 0.002 Å
• c: 16.936 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6947 ± 2 ų
• Cell temperature: 295 ± 1 K
• Ambient diffraction temperature: 295 ± 1 K
• Number of distinct elements: 6
• Hermann-Mauguin space group symbol: C 2 2 21
• Hall space group symbol: C 2c 2
• Residual factor for significantly intense reflections: 0.063
• Weighted residual factors for significantly intense reflections: 0.083
• Goodness-of-fit parameter for significantly intense reflections: 0.704
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No