Information card for entry 7045313

Structure parameters

• Formula: C42 H44 Al2 Br6 Eu N6 O2
• Calculated formula: C42 H44 Al2 Br6 Eu N6 O2
• SMILES: C([Al]12c3[n](c(Br)ccc3)[Eu]34([n]5c1cccc5Br)([n]1c2cccc1Br)[n]1c([Al](CC)(c2[n]3c(Br)ccc2)c2[n]4c(Br)ccc2)cccc1Br)C.C1OCCC1.C1CCCO1
• 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: 10.8508 ± 0.0002 Å
• b: 10.9222 ± 0.0002 Å
• c: 11.6496 ± 0.0003 Å
• α: 92.214 ± 0.001°
• β: 113.358 ± 0.001°
• γ: 108.481 ± 0.001°
• Cell volume: 1180.53 ± 0.05 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0646
• Residual factor for significantly intense reflections: 0.0459
• Weighted residual factors for significantly intense reflections: 0.124
• Weighted residual factors for all reflections included in the refinement: 0.1421
• Goodness-of-fit parameter for all reflections included in the refinement: 0.949
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No