Information card for entry 1556956

Structure parameters

• Formula: C15 H16 Cl2 Cu N4 O8
• Calculated formula: C15 Cl2 Cu N4 O8
• Title of publication: Synthesis of Open-Chain Schiff-Base Ligand 1,3-Di(pyridine-2-carboxaldimino)propane Incorporating Nitrogen-Donor Atoms and Crystal Structures of Its CoII, CuII and ZnII Complexes
• Authors of publication: Jantti, Anu; Rissanen, Kari; Valkonen, Jussi
• Journal of publication: Acta Chemica Scandinavica
• Year of publication: 1998
• Journal volume: 52
• Pages of publication: 1010 - 1016
• a: 14.419 ± 0.003 Å
• b: 7.118 ± 0.003 Å
• c: 19.704 ± 0.003 Å
• α: 90°
• β: 110.34 ± 0.01°
• γ: 90°
• Cell volume: 1896.2 ± 0.9 ų
• Ambient diffraction temperature: 180 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0471
• Residual factor for significantly intense reflections: 0.0378
• Weighted residual factors for significantly intense reflections: 0.1156
• Weighted residual factors for all reflections included in the refinement: 0.1244
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No