Information card for entry 4310096

Structure parameters

• Formula: C28 H28 Cl Cu N7 O4
• Calculated formula: C28 H28 Cl Cu N7 O4
• SMILES: [Cu]12([n]3ccccc3C=[N]1[C@@H](c1ccccc1)C)([n]1ccccc1C=[N]2[C@H](C)c1ccccc1)N=N#N.Cl(=O)(=O)(=O)[O-]
• Title of publication: One-Dimensional Azido-Bridged Chiral Metal Complexes with Ferromagnetic or Antiferromagnetic Interactions: Syntheses, Structures, and Magnetic Studies
• Authors of publication: He-Rui Wen; Cai-Feng Wang; You Song; Jing-Lin Zuo; Xiao-Zeng You
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 9039 - 9045
• a: 12.599 ± 0.005 Å
• b: 8.461 ± 0.003 Å
• c: 13.48 ± 0.005 Å
• α: 90°
• β: 96.006 ± 0.012°
• γ: 90°
• Cell volume: 1429.1 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0484
• Residual factor for significantly intense reflections: 0.0435
• Weighted residual factors for significantly intense reflections: 0.1009
• Weighted residual factors for all reflections included in the refinement: 0.1024
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No