Information card for entry 4083836

Structure parameters

• Formula: C39 H37 Ir N2 Si2
• Calculated formula: C39 H37 Ir N2 Si2
• SMILES: [IrH2]1([Si](C)(c2ccccc2)c2ccccc2)([Si](C)(c2ccccc2)c2ccccc2)n2c3ccccc3cc2c2[n]1cccc2
• Title of publication: Stoichiometric and Catalytic Reactions Involving Si−H Bond Activations by Rh and Ir Complexes Containing a Pyridylindolide Ligand
• Authors of publication: Karshtedt, Dmitry; Bell, Alexis T.; Tilley, T. Don
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 19
• Pages of publication: 4471
• a: 10.746 ± 0.0007 Å
• b: 11.5942 ± 0.0008 Å
• c: 14.648 ± 0.001 Å
• α: 98.463 ± 0.001°
• β: 98.369 ± 0.001°
• γ: 110.232 ± 0.001°
• Cell volume: 1655.39 ± 0.19 ų
• Cell temperature: 161.2 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: 0.0283
• Residual factor for significantly intense reflections: 0.0229
• Weighted residual factors for all reflections: 0.0276
• Weighted residual factors for all reflections included in the refinement: 0.0266
• Goodness-of-fit parameter for all reflections included in the refinement: 1.158
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No