Information card for entry 4117761

Structure parameters

• Chemical name: penta(2,2,6,6-tetramethyl-3,5-heptanedionate)-lithium(I)- di-manganese(II)
• Formula: C55 H95 Li Mn2 O10
• Calculated formula: C55 H95 Li Mn2 O10
• Title of publication: Volatile Single-Source Molecular Precursor for the Lithium Ion Battery Cathode
• Authors of publication: Anantharamulu Navulla; Lan Huynh; Zheng Wei; Alexander S. Filatov; Evgeny V. Dikarev
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2012
• Journal volume: 134
• Pages of publication: 5762 - 5765
• a: 11.59 ± 0.002 Å
• b: 20.246 ± 0.004 Å
• c: 27.885 ± 0.006 Å
• α: 68.834 ± 0.003°
• β: 84.406 ± 0.004°
• γ: 80.583 ± 0.003°
• Cell volume: 6014 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 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: 0.1392
• Residual factor for significantly intense reflections: 0.0721
• Weighted residual factors for significantly intense reflections: 0.1318
• Weighted residual factors for all reflections included in the refinement: 0.157
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No