Information card for entry 8107116

Structure parameters

• Formula: C62 H57 F2 N6 O16.5 Zn2
• Calculated formula: C62 H57 F2 N6 O16.5 Zn2
• Title of publication: Crystal structure of bis(biphenyl-2,2′-dicarboxylato-κ2 O:O′)-bis(1-cyclopropyl-6-fluoro-4-oxo-7-(1-piperazinyl)-1,4-dihydroquinoline-3-carboxylato-κ2 O,O′)dizinc(II)2.5 hydrate, C62H57N6Zn2O16.5F2
• Authors of publication: Hu, Yong-Jun; Zhu, Ling; An, Zhe; Zhou, Tian
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2016
• Journal volume: 231
• Journal issue: 4
• Pages of publication: 1111 - 1113
• a: 10.026 ± 0.004 Å
• b: 12.064 ± 0.004 Å
• c: 13.385 ± 0.005 Å
• α: 112.473 ± 0.003°
• β: 105.835 ± 0.004°
• γ: 91.309 ± 0.004°
• Cell volume: 1424.5 ± 0.9 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.029
• Residual factor for significantly intense reflections: 0.0266
• Weighted residual factors for significantly intense reflections: 0.0694
• Weighted residual factors for all reflections included in the refinement: 0.0707
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No