Information card for entry 4300120

Structure parameters

• Formula: C21 H36 Cl3 Cu Gd N2 O10
• Calculated formula: C21 H36 Cl3 Cu Gd N2 O10
• SMILES: [Gd]1234([Cu]567([O]1c1c(cccc1C=[N]5CC(C[N]6=Cc1c(c(ccc1)[O]4C)[O]37)(C)C)[O]2C)(Cl)Cl)([OH2])([OH2])([OH2])[OH2].[Cl-].O.O
• Title of publication: Influence of Anionic Ligands (X) on the Nature and Magnetic Properties of Dinuclear LCuGdX3.nH2O Complexes (LH2 Standing for Tetradentate Schiff Base Ligands Deriving from 2-Hydroxy-3-methoxybenzaldehyde and X Being Cl, N3C2, and CF3COO)
• Authors of publication: Jean-Pierre Costes; Françoise Dahan; Arnaud Dupuis
• Journal of publication: Inorganic Chemistry
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 165 - 168
• a: 9.0246 ± 0.0011 Å
• b: 16.5198 ± 0.0014 Å
• c: 20.286 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3024.3 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0314
• Residual factor for significantly intense reflections: 0.021
• Weighted residual factors for significantly intense reflections: 0.0513
• Weighted residual factors for all reflections included in the refinement: 0.0553
• Goodness-of-fit parameter for all reflections included in the refinement: 0.979
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No