Information card for entry 4072969

Structure parameters

• Formula: C25 H63 Nd O4 Si6
• Calculated formula: C25 H63 Nd O4 Si6
• SMILES: [Nd]123([O]([Si](C)(C)[C@@]2([Si](C)(C)C)[Si](C)(C)CC[Si](C)(C)[C@@]3([Si](C)(C)C)[Si]([O]1C)(C)C)C)(OC)[O]1CCCC1
• Title of publication: Synthesis and Structures of Ln(II) and Ln(III) Dialkyls Derived from LnI2(Ln = Nd, Tm, Yb)
• Authors of publication: Bowman, Lyndsey J.; Izod, Keith; Clegg, William; Harrington, Ross W.
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 10
• Pages of publication: 2646
• a: 9.6513 ± 0.0007 Å
• b: 16.9051 ± 0.0012 Å
• c: 12.0511 ± 0.0009 Å
• α: 90°
• β: 107.46 ± 0.001°
• γ: 90°
• Cell volume: 1875.6 ± 0.2 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0781
• Residual factor for significantly intense reflections: 0.0526
• Weighted residual factors for significantly intense reflections: 0.1155
• Weighted residual factors for all reflections included in the refinement: 0.1299
• Goodness-of-fit parameter for all reflections included in the refinement: 0.985
• Diffraction radiation wavelength: 0.6751 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No