Information card for entry 4075322

Structure parameters

• Formula: C15 H39 Al3 Mn O7
• Calculated formula: C15 H39 Al3 Mn O7
• SMILES: [Mn]12345[O](CC[O]1[Al]([O]([Al](C)(C)[O]3CC[O]2C)[Al](C)(C)[O]5CC[O]4C)(C)C)C
• Title of publication: Structural Characterization of Manganese(II) Compounds with Methylalumoxane (MAO) and AlMe2Units
• Authors of publication: Jerzykiewicz, Lucjan B.; Utko, Józef; Sobota, Piotr
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 20
• Pages of publication: 4924
• a: 8.995 ± 0.003 Å
• b: 9.55 ± 0.003 Å
• c: 15.102 ± 0.005 Å
• α: 90.09 ± 0.02°
• β: 90.27 ± 0.02°
• γ: 112.26 ± 0.02°
• Cell volume: 1200.6 ± 0.7 ų
• Cell temperature: 100 ± 1 K
• Ambient diffraction temperature: 100 ± 1 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0382
• Residual factor for significantly intense reflections: 0.0326
• Weighted residual factors for significantly intense reflections: 0.0718
• Weighted residual factors for all reflections included in the refinement: 0.0741
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No