Information card for entry 2226368

Structure parameters

• Chemical name: Bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(sulfato- κ^2^<i>O</i>,<i>O</i>')cadmium(II) propane-1,3-diol solvate
• Formula: C27 H24 Cd N4 O6 S
• Calculated formula: C27 H24 Cd N4 O6 S
• Title of publication: Bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')(sulfato-κ^2^<i>O</i>,<i>O</i>')cadmium(II) propane-1,3-diol solvate
• Authors of publication: Zhong, Kai-Long; Cui, Jiang-Dong
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 7
• Pages of publication: m817 - m818
• a: 17.854 ± 0.004 Å
• b: 12.52 ± 0.003 Å
• c: 13.519 ± 0.003 Å
• α: 90°
• β: 123.01 ± 0.03°
• γ: 90°
• Cell volume: 2534.1 ± 1.3 ų
• Cell temperature: 223.15 K
• Ambient diffraction temperature: 223.15 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0314
• Residual factor for significantly intense reflections: 0.028
• Weighted residual factors for significantly intense reflections: 0.0701
• Weighted residual factors for all reflections included in the refinement: 0.0717
• Goodness-of-fit parameter for all reflections included in the refinement: 1.103
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes