Information card for entry 8107078

Structure parameters

• Formula: C32 H44 F2 N6 Ni O11
• Calculated formula: C32 H44 F2 N6 Ni O11
• Title of publication: Crystal structure of the catena-poly-[bis(μ2-1-ethyl-6-fluoro-4-oxo-7-(piperazin-1-yl-κN)-1,4-dihydroquinoline-3-carboxylato-κ2 O,O′)nickel(II)] 5.5 hydrate, C32H44N6NiO11F2
• Authors of publication: An, Zhe; Zhu, Ling; Zhao, Xin-Hua
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2016
• Journal volume: 231
• Journal issue: 4
• Pages of publication: 1007 - 1008
• a: 10.4372 ± 0.0005 Å
• b: 11.4647 ± 0.0005 Å
• c: 17.0628 ± 0.001 Å
• α: 90°
• β: 122.508 ± 0.004°
• γ: 90°
• Cell volume: 1721.82 ± 0.17 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.0834
• Residual factor for significantly intense reflections: 0.0509
• Weighted residual factors for significantly intense reflections: 0.1227
• Weighted residual factors for all reflections included in the refinement: 0.138
• Goodness-of-fit parameter for all reflections included in the refinement: 0.991
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No