Information card for entry 4312060

Structure parameters

• Formula: C24 H30 Cu Gd N5 O14
• Calculated formula: C24 H30 Cu Gd N5 O14
• SMILES: [Cu]123([O]4[Gd]56789(ON(=O)=[O]8)(ON(=[O]9)=O)([O]3c3c([O]7CC)cccc3C=[N]1CCC[N]2=Cc1c4c([O]6CC)ccc1)[O]=N(=O)O5)[O]=C(C)C
• Title of publication: Synthesis, Structure, and Magnetic Properties of Heterometallic Dicyanamide-Bridged Cu-Na and Cu-Gd One-Dimensional Polymers
• Authors of publication: Jean-Pierre Costes; Ghenadie Novitchi; Sergiu Shova; Françoise Dahan; Bruno Donnadieu; Jean-Pierre Tuchagues
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 7792 - 7799
• a: 9.522 ± 0.005 Å
• b: 15.774 ± 0.005 Å
• c: 20.347 ± 0.005 Å
• α: 90 ± 0.005°
• β: 93.503 ± 0.005°
• γ: 90 ± 0.005°
• Cell volume: 3050 ± 2 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0293
• Residual factor for significantly intense reflections: 0.0265
• Weighted residual factors for significantly intense reflections: 0.0692
• Weighted residual factors for all reflections included in the refinement: 0.0744
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No