Information card for entry 8106101

Structure parameters

• Formula: C26 H26 Cl2 Cu N2 O7
• Calculated formula: C26 H26 Cl2 Cu N2 O7
• Title of publication: The crystal structure of catena-poly[aquachlorido(3,3′-([4,4′-bipyridine]-1,1′-diium-1,1′-diylbis(methylene))dibenzoato-κ2 O:O′)copper(II)] chloride dihydrate, C26H26Cl2CuN2O7
• Authors of publication: Gao, Xiaoli; Zhu, Kai; Wang, Wenmin; Lu, Liping
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2018
• Journal volume: 233
• Journal issue: 2
• Pages of publication: 209 - 211
• a: 17.225 ± 0.004 Å
• b: 14.918 ± 0.003 Å
• c: 11.589 ± 0.003 Å
• α: 90°
• β: 118.957 ± 0.003°
• γ: 90°
• Cell volume: 2605.6 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0374
• Residual factor for significantly intense reflections: 0.0334
• Weighted residual factors for significantly intense reflections: 0.0794
• Weighted residual factors for all reflections included in the refinement: 0.0819
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No