Information card for entry 2209929

Structure parameters

• Formula: C30 H30 N14 Ni O6
• Calculated formula: C30 H30 N14 Ni O6
• SMILES: c1[n]2c(c(cc1)N)c1c(ccc[n]1[Ni]132([n]2cccc(c2c2c(ccc[n]32)N)N)[n]2cccc(c2c2c(ccc[n]12)N)N)N.N(=O)(=O)[O-].N(=O)(=O)[O-]
• Title of publication: Tris(3,3'-diamino-2,2'-bipyridine)nickel(II) dinitrate
• Authors of publication: Min, Shi Jing; Na, Chen Ju; Dong, Liu Lian
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 8
• Pages of publication: m1810 - m1811
• a: 14.537 ± 0.002 Å
• b: 14.537 ± 0.002 Å
• c: 13.125 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 2402 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 155
• Hermann-Mauguin space group symbol: R 3 2 :H
• Hall space group symbol: R 3 2"
• Residual factor for all reflections: 0.0758
• Residual factor for significantly intense reflections: 0.0611
• Weighted residual factors for significantly intense reflections: 0.0943
• Weighted residual factors for all reflections included in the refinement: 0.099
• Goodness-of-fit parameter for all reflections included in the refinement: 1.117
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes