Information card for entry 2006307

Structure parameters

• Formula: C26 H36 I N2 Nd Si2
• Calculated formula: C26 H36 I N2 Nd Si2
• SMILES: I[Nd]12345678([cH]9[cH]1[c]2([Si](C)(C)C)[cH]3[cH]49)([cH]1[cH]5[c]6([Si](C)(C)C)[cH]7[cH]18)([n]1ccccc1)[n]1ccccc1
• Title of publication: Iodobis(pyridine-<i>N</i>)bis(η^5^-trimethylsilylcyclopentadienyl)neodymium
• Authors of publication: Clark, David L.; Gordon, John C.; Scott, Brian L.; Watkin, John G.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1997
• Journal volume: 53
• Journal issue: 7
• Pages of publication: 850 - 852
• a: 27.001 ± 0.002 Å
• b: 27.001 ± 0.002 Å
• c: 21.525 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 13590 ± 3 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 6
• Space group number: 167
• Hermann-Mauguin space group symbol: R -3 c :H
• Hall space group symbol: -R 3 2"c
• Residual factor for all reflections: 0.0254
• Residual factor for significantly intense reflections: 0.0197
• Weighted residual factors for all reflections: 0.043
• Weighted residual factors for significantly intense reflections: 0.0413
• Goodness-of-fit parameter for all reflections: 1.058
• Goodness-of-fit parameter for significantly intense reflections: 1.081
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No