Information card for entry 4320482

Structure parameters

• Formula: C32 H40 Cl2 Cu3 N4 O19
• Calculated formula: C32 H32 Cl2 Cu3 N4 O19
• Title of publication: Interconversion of a Monomer and Two Coordination Polymers of a Copper(II)-Reduced Schiff Base Ligand-1,10-Phenanthroline Complex Based on Hydrogen- and Coordinative-Bonding
• Authors of publication: Chang Tong Yang; Boujemaa Moubaraki; Keith S. Murray; John D. Ranford; Jagadese Jayapurandara Vittal
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 5934 - 5941
• a: 12.0353 ± 0.0005 Å
• b: 12.2848 ± 0.0005 Å
• c: 15.3185 ± 0.0006 Å
• α: 84.993 ± 0.001°
• β: 89.411 ± 0.001°
• γ: 67.414 ± 0.001°
• Cell volume: 2082.51 ± 0.15 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.1363
• Residual factor for significantly intense reflections: 0.0803
• Weighted residual factors for significantly intense reflections: 0.1775
• Weighted residual factors for all reflections included in the refinement: 0.206
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No