Information card for entry 4075157

Structure parameters

• Formula: C28 H68 I2 Li Nd O4 Si6
• Calculated formula: C28 H68 I2 Li Nd O4 Si6
• Title of publication: Heteroleptic Complexes of Lanthanum(III) and Neodymium(III) with Oxygen- or Nitrogen-Functionalized Tris(triorganosilyl)methyl Ligands
• Authors of publication: Bowman, Lyndsey J.; Izod, Keith; Clegg, William; Harrington, Ross W.
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 12
• Pages of publication: 2999
• a: 12.9819 ± 0.0011 Å
• b: 10.6242 ± 0.001 Å
• c: 32.828 ± 0.002 Å
• α: 90°
• β: 97.802 ± 0.009°
• γ: 90°
• Cell volume: 4485.8 ± 0.6 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• 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: 0.0612
• Residual factor for significantly intense reflections: 0.046
• Weighted residual factors for significantly intense reflections: 0.1282
• Weighted residual factors for all reflections included in the refinement: 0.1396
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No