Information card for entry 8102864

Structure parameters

• Chemical name: [Cu(C11H6NO4)2]
• Formula: C22 H12 Cu N2 O8
• Calculated formula: C22 H12 Cu N2 O8
• Title of publication: Crystal structure of bis(hydrogen 2,3-quinolinedicarboxylato)copper(II), Cu(C11H6NO4)2
• Authors of publication: Xiao-Ling Li; Guang-Zhen Liu
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2010
• Journal volume: 225
• Journal issue: 4
• Pages of publication: 761
• a: 12.6992 ± 0.0014 Å
• b: 5.801 ± 0.0007 Å
• c: 13.5977 ± 0.0015 Å
• α: 90°
• β: 115.89 ± 0.001°
• γ: 90°
• Cell volume: 901.18 ± 0.18 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0265
• Residual factor for significantly intense reflections: 0.0244
• Weighted residual factors for significantly intense reflections: 0.0709
• Weighted residual factors for all reflections included in the refinement: 0.0724
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No