Information card for entry 7020597

Structure parameters

• Formula: C26 H32 Cu N10 O11 Tb W
• Calculated formula: C26 H18 Cu N10 O11 Tb W
• SMILES: C[O]1c2c3c(C=[N]4CC[N]5=Cc6cccc7c6[O]6[Cu]45[O]3[Tb]16([O]7C)([OH2])([OH2])([OH2])([OH2])[OH2])ccc2.C(#N)[W](C#N)(C#N)(C#N)(C#N)(C#N)(C#N)C#N.O.O
• Title of publication: Self-assembly of [Cu(II)Tb(III)](3+) and [W(CN)(8)](3-) tectons: a case study of a mixture containing two complexes showing slow-relaxation of the magnetization.
• Authors of publication: Visinescu, Diana; Jeon, Ie-Rang; Madalan, Augustin M.; Alexandru, Maria-Gabriela; Jurca, Bogdan; Mathonière, Corine; Clérac, Rodolphe; Andruh, Marius
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2012
• Journal volume: 41
• Journal issue: 44
• Pages of publication: 13578 - 13581
• a: 9.9903 ± 0.0002 Å
• b: 26.4341 ± 0.0007 Å
• c: 13.322 ± 0.0003 Å
• α: 90°
• β: 101.056 ± 0.002°
• γ: 90°
• Cell volume: 3452.84 ± 0.14 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• 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: 0.0653
• Residual factor for significantly intense reflections: 0.0481
• Weighted residual factors for significantly intense reflections: 0.1178
• Weighted residual factors for all reflections included in the refinement: 0.1254
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No