Information card for entry 7045314

Structure parameters

• Formula: C40 H46 Al2 N6 Yb
• Calculated formula: C40 H46 Al2 N6 Yb
• SMILES: [Yb]1234([n]5c([Al](CC)(c6[n]1c(ccc6)C)c1[n]2c(ccc1)C)cccc5C)[n]1c([Al](CC)(c2[n]3c(ccc2)C)c2[n]4c(ccc2)C)cccc1C
• Title of publication: Modifying the donor properties of tris(pyridyl)aluminates in lanthanide(ii) sandwich compounds.
• Authors of publication: García-Rodríguez, Raúl; Kopf, Sara; Wright, Dominic S.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 7
• Pages of publication: 2232 - 2239
• a: 11.732 ± 0.002 Å
• b: 19.517 ± 0.003 Å
• c: 16.296 ± 0.003 Å
• α: 90°
• β: 96.376 ± 0.006°
• γ: 90°
• Cell volume: 3708.3 ± 1.1 ų
• Cell temperature: 199 ± 2 K
• Ambient diffraction temperature: 199 ± 2 K
• Number of distinct elements: 5
• 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: 0.1362
• Residual factor for significantly intense reflections: 0.0652
• Weighted residual factors for significantly intense reflections: 0.1319
• Weighted residual factors for all reflections included in the refinement: 0.1585
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No