Information card for entry 2237113

Structure parameters

• Chemical name: Bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(sulfato-<i>O</i>)copper(II) butane-2,3-diol monosolvate
• Formula: C28 H26 Cu N4 O6 S
• Calculated formula: C28 H26 Cu N4 O6 S
• Title of publication: Bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(sulfato-<i>O</i>)copper(II) butane-2,3-diol monosolvate
• Authors of publication: Zhong, Kai-Long; Cao, Guo-Qing
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 1
• Pages of publication: m40 - m41
• a: 17.352 ± 0.004 Å
• b: 13.07 ± 0.003 Å
• c: 13.444 ± 0.003 Å
• α: 90°
• β: 123.84 ± 0.03°
• γ: 90°
• Cell volume: 2532.5 ± 1.3 ų
• Cell temperature: 223.15 K
• Ambient diffraction temperature: 223.15 K
• Number of distinct elements: 6
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0561
• Residual factor for significantly intense reflections: 0.0459
• Weighted residual factors for significantly intense reflections: 0.1226
• Weighted residual factors for all reflections included in the refinement: 0.1346
• Goodness-of-fit parameter for all reflections included in the refinement: 0.992
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes