Information card for entry 4330472

Structure parameters

• Formula: C78 H103 Cl La2 N4 Ni2 O20
• Calculated formula: C78 H95 Cl La2 N4 Ni2 O20
• SMILES: [La]12345([O]6[Ni]789%10[O]([La]%11%12%13([O]%14[Ni]%15%16([O]2c2c(C[N]%16(CC[N]%15(Cc%15c%14c(C)cc(c%15)C)C)C)cc(cc2C)C)([O]38%11)[O]4%12)([O]17)([O]=C(C=C(O%13)c1ccccc1)c1ccccc1)OC)c1c(cc(cc1C)C)C[N]%10(C)CC[N]9(Cc1c6c(cc(c1)C)C)C)([O]=C(c1ccccc1)C=C(O5)c1ccccc1)OC.Cl(=O)(=O)(=O)[O-].OC.OC.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: 12.5011 ± 0.0005 Å
• b: 23.4242 ± 0.001 Å
• c: 28.2129 ± 0.0012 Å
• α: 90°
• β: 92.853 ± 0.002°
• γ: 90°
• Cell volume: 8251.3 ± 0.6 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 7
• 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: 0.0861
• Residual factor for significantly intense reflections: 0.0627
• Weighted residual factors for significantly intense reflections: 0.1835
• Weighted residual factors for all reflections included in the refinement: 0.197
• Goodness-of-fit parameter for all reflections included in the refinement: 1.322
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No