Information card for entry 2103650

Structure parameters

• Common name: di(2-aminopyridine)-bis(cupferronato)nickel(II)
• Chemical name: di(2-aminopyridine)-bis(N-nitroso-N-phenylhydroxylaminato)-nickel(II)
• Formula: C22 H22 N8 Ni O4
• Calculated formula: C22 H22 N8 Ni O4
• SMILES: [Ni]12(ON(N=[O]1)c1ccccc1)(ON(N=[O]2)c1ccccc1)([n]1c(N)cccc1)[n]1c(N)cccc1
• Title of publication: Hydrogen-bonded hexagonal and pseudo-hexagonal grid motifs in supramolecular cobalt(II) and nickel(II) cupferronato complexes incorporating neutral N-donors with intermolecular NH~2~ connectors and solvent molecules
• Authors of publication: Deák, Andrea; Kálmán, Alajos; Párkányi, László; Haiduc, Ionel
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 3
• Pages of publication: 303 - 310
• a: 8.321 ± 0.001 Å
• b: 11.535 ± 0.002 Å
• c: 24.852 ± 0.002 Å
• α: 90°
• β: 91.55 ± 0.01°
• γ: 90°
• Cell volume: 2384.5 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0926
• Residual factor for significantly intense reflections: 0.0359
• Weighted residual factors for all reflections included in the refinement: 0.0947
• Goodness-of-fit parameter for all reflections included in the refinement: 0.93
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes