Information card for entry 2234819

Structure parameters

• Chemical name: Bis[μ-<i>N</i>-(2-oxidobenzylidene)pyridine-2- carbohydrazidato]bis[chlorido(methanol-κ<i>O</i>)erbium(III)]
• Formula: C28 H26 Cl2 Er2 N6 O6
• Calculated formula: C28 H26 Cl2 Er2 N6 O6
• SMILES: c1cccc2C3=N[N]4=Cc5c(O[Er]674([n]4ccccc4C4=N[N]8=Cc9c(O[Er]8(Cl)([n]12)([O]36)([O]74)[OH]C)cccc9)([OH]C)Cl)cccc5
• Title of publication: Bis[μ-<i>N</i>-(2-oxidobenzylidene)pyridine-2-carbohydrazidato]bis[chlorido(methanol-κ<i>O</i>)erbium(III)]
• Authors of publication: Yang, Hua
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 5
• Pages of publication: m580 - m581
• a: 9.581 ± 0.0004 Å
• b: 7.0906 ± 0.0003 Å
• c: 22.3504 ± 0.0008 Å
• α: 90°
• β: 96.92 ± 0.003°
• γ: 90°
• Cell volume: 1507.31 ± 0.11 ų
• Cell temperature: 128 ± 2 K
• Ambient diffraction temperature: 128 ± 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: 0.0425
• Residual factor for significantly intense reflections: 0.0266
• Weighted residual factors for significantly intense reflections: 0.0544
• Weighted residual factors for all reflections included in the refinement: 0.0592
• Goodness-of-fit parameter for all reflections included in the refinement: 0.986
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes