Information card for entry 2008123

Structure parameters

• Chemical name: (4,4'-bipyridine)bis(1,3-diaminopropane)nickel(II) perchlorate
• Formula: C16 H28 Cl2 N6 Ni O8
• Calculated formula: C16 H28 Cl2 N6 Ni O8
• SMILES: [Ni]12([n]3ccc(cc3)c4cc[n](cc4)[Ni]34([NH2]CCC[NH2]3)[NH2]CCC[NH2]4)([n]3ccc(c4cc[n]cc4)cc3)([NH2]CCC[NH2]1)[NH2]CCC[NH2]2.Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-]
• Title of publication: <i>catena</i>-Poly[[[bis(1,3-diaminopropane-<i>N</i>,<i>N</i>')nickel(II)]-μ-(4,4'-bipyridine-<i>N</i>:<i>N</i>')] diperchlorate]
• Authors of publication: Tong, Ye-Xiang; Tong, Ming-Liang; Yu, Xiao-Lan; Chen, Xiao-Ming
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 2
• Pages of publication: 180 - 182
• a: 14.348 ± 0.006 Å
• b: 11.493 ± 0.006 Å
• c: 13.936 ± 0.006 Å
• α: 90°
• β: 95.43 ± 0.04°
• γ: 90°
• Cell volume: 2287.8 ± 1.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.046
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for all reflections: 0.091
• Weighted residual factors for significantly intense reflections: 0.084
• Goodness-of-fit parameter for all reflections: 1.07
• Goodness-of-fit parameter for significantly intense reflections: 1.106
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No