Information card for entry 4308936

Structure parameters

• Formula: C28 H18 Cu2 N16 O6
• Calculated formula: C28 H18 Cu2 N16 O6
• Title of publication: New Magnetic Copper(II) Coordination Polymers with the Polynitrile Ligand (C[C(CN)2]3)2- and N-Donor Co-ligands
• Authors of publication: Smaïl Triki; Franck Thétiot; Fanny Vandevelde; Jean Sala-Pala; Carlos J. Gómez-García
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 4086 - 4093
• a: 7.7495 ± 0.0004 Å
• b: 9.8432 ± 0.0006 Å
• c: 10.9787 ± 0.0008 Å
• α: 97.6 ± 0.2°
• β: 101.2 ± 0.2°
• γ: 90.076 ± 0.005°
• Cell volume: 814 ± 0.7 ų
• Cell temperature: 288 K
• Ambient diffraction temperature: 288 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.07
• Residual factor for significantly intense reflections: 0.045
• Weighted residual factors for all reflections: 0.103
• Weighted residual factors for all reflections included in the refinement: 0.05
• Goodness-of-fit parameter for all reflections: 1.962
• Goodness-of-fit parameter for all reflections included in the refinement: 1.006
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No