Information card for entry 4304014

Structure parameters

• Formula: C40 H104 Li8 N8 O4 Si8
• Calculated formula: C40 H104 Li8 N8 O4 Si8
• SMILES: [Si]1([O]234[Li]56[N]1(CCC)[Si](C)(C)[N]15(CCC)[Li]57[O]89%10[Si](C)(C)[N]5(CCC)[Si](C)(C)[N]67(CCC)[Li]28[O]256[Si](C)(C)[N]7(CCC)[Si](C)(C)[N]8%11(CCC)[Li]45[O]45([Si](C)(C)[N]%12(CCC)[Si](C)(C)[N](CCC)([Li]%1024)([Li]678)[Li]%115%12)[Li]319)(C)C
• Title of publication: Synthesis, Structures, and Kinetics of Mixed-Donor Amido-Amino-Siloxo Ligands from Symmetrical Diamidosilyl Ether Ligands via a Retro-Brook Rearrangement
• Authors of publication: Farzad Haftbaradaran; Angela M. Kuchison; Michael J. Katz; Gabriele Schatte; Daniel B. Leznoff
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 812 - 822
• a: 12.0534 ± 0.0001 Å
• b: 15.7902 ± 0.0002 Å
• c: 17.6785 ± 0.0002 Å
• α: 75.985 ± 0.001°
• β: 80.235 ± 0.001°
• γ: 85.409 ± 0.001°
• Cell volume: 3214.54 ± 0.06 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0599
• Residual factor for significantly intense reflections: 0.0367
• Weighted residual factors for significantly intense reflections: 0.0864
• Weighted residual factors for all reflections included in the refinement: 0.0972
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No