Information card for entry 7009623

Structure parameters

• Common name: [Li(tmeda)(Me3SiNCPhCHPh)]
• Formula: C23 H36 Li N3 Si
• Calculated formula: C23 H36 Li N3 Si
• SMILES: [Si](N([Li]1[N](C)(C)CC[N]1(C)C)C(=Cc1ccccc1)c1ccccc1)(C)(C)C
• Title of publication: Reactions of LiCHR2 and related lithium alkyls with α-H free nitriles and the crystal structures of eleven representative lithium 1,3-diazaallyls, 1-azaallyls and β-diketiminates
• Authors of publication: Hitchcock, Peter B.; Lappert, Michael F.; Layh, Marcus; Liu, Dian-Sheng; Sablong, Rafael; Shun, Tian
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2000
• Journal issue: 14
• Pages of publication: 2301
• a: 10.0529 ± 0.0003 Å
• b: 31.5904 ± 0.001 Å
• c: 8.2296 ± 0.0002 Å
• α: 90°
• β: 111.457 ± 0.003°
• γ: 90°
• Cell volume: 2432.38 ± 0.13 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• 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: 0.0997
• Residual factor for significantly intense reflections: 0.0573
• Weighted residual factors for significantly intense reflections: 0.1346
• Weighted residual factors for all reflections included in the refinement: 0.1532
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No