Information card for entry 2211546

Structure parameters

• Chemical name: Di-μ-succinato-κ^4^O:O'-bis[diaqua(1,10-phenanthroline- κ^2^N,N')cadmium(II)] dihydrate
• Formula: C32 H36 Cd2 N4 O14
• Calculated formula: C32 H36 Cd2 N4 O14
• SMILES: C1(=O)CCC(=O)O[Cd]2([n]3cccc4c3c3[n]2cccc3cc4)(OC(=O)CCC(=O)O[Cd]2([n]3cccc4c3c3[n]2cccc3cc4)(O1)([OH2])[OH2])([OH2])[OH2].O.O
• Title of publication: Di-μ-succinato-κ^4^<i>O</i>:<i>O</i>'-bis[diaqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II)] dihydrate
• Authors of publication: Qing-Wei Wang; Xiu-Mei Li; Guang-Gang Gao; Lin-Fang Shi
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 12
• Pages of publication: m3483 - m3485
• a: 8.1775 ± 0.0016 Å
• b: 8.4059 ± 0.0017 Å
• c: 13.064 ± 0.003 Å
• α: 95.13 ± 0.03°
• β: 104.18 ± 0.03°
• γ: 104.86 ± 0.03°
• Cell volume: 830.4 ± 0.4 ų
• Cell temperature: 292 ± 2 K
• Ambient diffraction temperature: 292 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0212
• Residual factor for significantly intense reflections: 0.0208
• Weighted residual factors for significantly intense reflections: 0.0556
• Weighted residual factors for all reflections included in the refinement: 0.0559
• Goodness-of-fit parameter for all reflections included in the refinement: 1.134
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes