Information card for entry 2235668

Structure parameters

• Chemical name: Poly[diaquabis(nitrato-κ^2^<i>O</i>,<i>O</i>')bis(1,10-phenanthroline- κ^2^<i>N</i>,<i>N</i>')-μ~3~-succinato-dicadmium]
• Formula: C28 H24 Cd2 N6 O12
• Calculated formula: C28 H24 Cd2 N6 O12
• SMILES: [Cd]123([OH2])([O]=N(=O)O2)([n]2c4c(ccc5c4[n]3ccc5)ccc2)[O](C(=O)CCC(=O)[O-])[Cd]23([O]=N(=O)O2)([OH2])([n]2cccc4c2c2[n]3cccc2cc4)[O]1C(=O)CCC(=O)[O]([Cd]12([O]=N(=O)O1)([OH2])[n]1cccc3c1c1[n]2cccc1cc3)[Cd]12([O]=N(=O)O1)([OH2])[n]1cccc3c1c1[n]2cccc1cc3
• Title of publication: Poly[diaquabis(nitrato-κ^2^<i>O</i>,<i>O</i>')bis(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')-μ~3~-succinato-dicadmium]
• Authors of publication: Li, Hong-Jin; Gao, Zhu-Qing; Gu, Jin-Zhong
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 7
• Pages of publication: m899
• a: 7.7349 ± 0.0013 Å
• b: 9.4467 ± 0.0016 Å
• c: 11.2063 ± 0.0018 Å
• α: 102.284 ± 0.002°
• β: 106.059 ± 0.002°
• γ: 107.003 ± 0.002°
• Cell volume: 713 ± 0.2 ų
• Cell temperature: 110 ± 2 K
• Ambient diffraction temperature: 110 ± 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: 0.0332
• Residual factor for significantly intense reflections: 0.0256
• Weighted residual factors for significantly intense reflections: 0.0625
• Weighted residual factors for all reflections included in the refinement: 0.0864
• Goodness-of-fit parameter for all reflections included in the refinement: 1.097
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes