Information card for entry 2013315

Structure parameters

• Formula: C22 H28 N2 Ni O10
• Calculated formula: C22 H28 N2 Ni O10
• SMILES: [Ni]12([OH2])([OH2])(OC(=O)c4ccc3ccccc3[n]14)OC(=O)c1ccc3ccccc3[n]12.OC.O.OC.O
• Title of publication: Cobalt(II) and nickel(II) complexes of quinoline-2-carboxylate
• Authors of publication: Okabe, Nobuo; Muranishi, Yasunori
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 6
• Pages of publication: m228 - m230
• a: 7.127 ± 0.002 Å
• b: 8.909 ± 0.003 Å
• c: 10.769 ± 0.002 Å
• α: 76.74 ± 0.02°
• β: 74.39 ± 0.01°
• γ: 70.66 ± 0.02°
• Cell volume: 613.9 ± 0.3 ų
• Cell temperature: 296.2 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 significantly intense reflections: 0.0378
• Weighted residual factors for all reflections included in the refinement: 0.1111
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No