Information card for entry 4110433

Structure parameters

• Common name: Dimitry-77 new
• Formula: C30 H66 F Li O3 Si3
• Calculated formula: C30 H66 F Li O3 Si3
• SMILES: [Si]([Si](C)(C(C)(C)C)C(C)(C)C)([Si](C)(C(C)(C)C)C(C)(C)C)[F][Li]([O]1CCCC1)([O]1CCCC1)[O]1CCCC1
• Title of publication: Synthesis, Molecular Structure, and Reactivity of the Isolable Silylenoid with a Tricoordinate Silicon
• Authors of publication: Gregory Molev; Dmitry Bravo-Zhivotovskii; Miriam Karni; Boris Tumanskii; Mark Botoshansky; Yitzhak Apeloig
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2006
• Journal volume: 128
• Pages of publication: 2784 - 2785
• a: 11.181 ± 0.002 Å
• b: 18.49 ± 0.004 Å
• c: 19.334 ± 0.004 Å
• α: 90°
• β: 111.4 ± 0.03°
• γ: 90°
• Cell volume: 3721.5 ± 1.5 ų
• Cell temperature: 180 ± 1 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 6
• 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: 0.1237
• Residual factor for significantly intense reflections: 0.0633
• Weighted residual factors for significantly intense reflections: 0.1605
• Weighted residual factors for all reflections included in the refinement: 0.1801
• Goodness-of-fit parameter for all reflections included in the refinement: 0.955
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No