Information card for entry 7025614

Structure parameters

• Formula: C25 H59 Al2 O8 Pr
• Calculated formula: C25 H59 Al2 O8 Pr
• SMILES: [Pr]123456([O]7CC[O]1CC[O]2CC[O]3CC7)([O]1CC[O]4CC[O]5CC[O]6CC1)C.[Al](C)(C)(C)C.[Al](C)(C)(C)C
• Title of publication: Cationic rare-earth-metal methyl complexes: a new preparative access exemplified for Y and Pr.
• Authors of publication: Nieland, Anja; Mix, Andreas; Neumann, Beate; Stammler, Hans-Georg; Mitzel, Norbert W.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 29
• Pages of publication: 6753 - 6760
• a: 11.031 ± 0.002 Å
• b: 20.9866 ± 0.0015 Å
• c: 14.514 ± 0.003 Å
• α: 90°
• β: 95.581 ± 0.015°
• γ: 90°
• Cell volume: 3344.1 ± 1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0353
• Residual factor for significantly intense reflections: 0.0234
• Weighted residual factors for significantly intense reflections: 0.0453
• Weighted residual factors for all reflections included in the refinement: 0.0494
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No