Information card for entry 4330471

Structure parameters

• Formula: C77 H97 Dy2 N5 Ni2 O17
• Calculated formula: C77 H91 Dy2 N5 Ni2 O17
• SMILES: [Dy]12345([O]67[Dy]89%10(OC(=CC(=[O]9)c9ccccc9)c9ccccc9)([O]9[Ni]%11%126([O]1c1c(C[N]%12(C)CC[N]%11(Cc6c9c(C)cc(c6)C)C)cc(cc1C)C)[O]38)([O]1[Ni]367([O]2c2c(C)cc(cc2C[N]3(C)CC[N]6(C)Cc2c1c(cc(c2)C)C)C)[O]5%10)[OH]C)(OC(=CC(=[O]4)c1ccccc1)c1ccccc1)OC.OC.N(=O)(=O)[O-]
• Title of publication: Syntheses, Structures, and Magnetic Properties of a Family of Tetranuclear Hydroxido-Bridged NiII2LnIII2 (Ln = La, Gd, Tb, and Dy) Complexes: Display of Slow Magnetic Relaxation by the Zinc(II)-Dysprosium(III) Analogue
• Authors of publication: Sk Md Towsif Abtab; Manoranjan Maity; Kisholoy Bhattacharya; E. Carolina Sañudo; Muktimoy Chaudhury
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 10211 - 10221
• a: 12.6254 ± 0.0007 Å
• b: 23.2459 ± 0.0013 Å
• c: 27.3308 ± 0.0016 Å
• α: 90°
• β: 92.947 ± 0.002°
• γ: 90°
• Cell volume: 8010.7 ± 0.8 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 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: 0.0985
• Residual factor for significantly intense reflections: 0.069
• Weighted residual factors for significantly intense reflections: 0.2031
• Weighted residual factors for all reflections included in the refinement: 0.2211
• Goodness-of-fit parameter for all reflections included in the refinement: 1.404
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No