Information card for entry 7205290

Structure parameters

• Formula: C19 H20 N2 Ni O11
• Calculated formula: C19 H10 N2 Ni O11
• SMILES: [Ni]1([n]2cccc3c2c2[n]1cccc2cc3)(OC(=O)c1oc(cc(=O)c1)C(=O)[O-])([OH2])([OH2])[OH2].O.O
• Title of publication: Mononuclear discrete complexes and coordination polymers based on metal(ii) chelidonate complexes with aromatic N,N-chelating ligands
• Authors of publication: Lago, Ana Belén; Carballo, Rosa; Fernández-Hermida, Nuria; Vázquez-López, Ezequiel M.
• Journal of publication: CrystEngComm
• Year of publication: 2011
• Journal volume: 13
• Journal issue: 3
• Pages of publication: 941
• a: 10.9267 ± 0.0015 Å
• b: 23.869 ± 0.004 Å
• c: 8.9977 ± 0.0013 Å
• α: 90°
• β: 113.911 ± 0.003°
• γ: 90°
• Cell volume: 2145.3 ± 0.6 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/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.142
• Residual factor for significantly intense reflections: 0.0829
• Weighted residual factors for significantly intense reflections: 0.2139
• Weighted residual factors for all reflections included in the refinement: 0.2581
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No