Information card for entry 4330473

Structure parameters

• Formula: C77 H97 N5 Ni2 O17 Tb2
• Calculated formula: C77 H87 N5 Ni2 O17 Tb2
• SMILES: [Tb]12345([O]6[Ni]789%10[O]([Tb]%11%12%13(OC(=CC(=[O]%13)c%13ccccc%13)c%13ccccc%13)([O]%13[Ni]%14%15([O]2c2c(cc(cc2C[N]%14(C)CC[N]%15(C)Cc2c%13c(cc(c2)C)C)C)C)([O]38%11)[O]4%12)([O]17)[OH]C)c1c(C)cc(cc1C[N]%10(CC[N]9(Cc1c6c(cc(c1)C)C)C)C)C)(OC(=CC(=[O]5)c1ccccc1)c1ccccc1)OC.N(=O)(=O)[O-].OC
• 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: 12.6371 ± 0.0005 Å
• b: 23.2036 ± 0.001 Å
• c: 27.4871 ± 0.0011 Å
• α: 90°
• β: 93.003 ± 0.002°
• γ: 90°
• Cell volume: 8048.9 ± 0.6 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: 0.0901
• Residual factor for significantly intense reflections: 0.0684
• Weighted residual factors for significantly intense reflections: 0.2154
• Weighted residual factors for all reflections included in the refinement: 0.2276
• Goodness-of-fit parameter for all reflections included in the refinement: 1.547
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No