Information card for entry 4302323

Structure parameters

• Formula: C23 H32 Fe N2 O5 Si
• Calculated formula: C23 H32 Fe N2 O5 Si
• SMILES: [Fe]([Si]1([N](=C(N1C(C)(C)C)c1ccccc1)C(C)(C)C)OC(C)(C)C)(C#[O])(C#[O])(C#[O])C#[O]
• Title of publication: A Base-Stabilized Silylene with a Tricoordinate Silicon Atom as a Ligand for a Metal Complex
• Authors of publication: Yang, Wei; Fu, Hao; Wang, Haijun; Chen, Mingqing; Ding, Yuqiang; Roesky, Herbert W.; Jana, Anukul
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Journal issue: 12
• Pages of publication: 5058 - 5060
• a: 9.1551 ± 0.0007 Å
• b: 16.6045 ± 0.0014 Å
• c: 17.2613 ± 0.0015 Å
• α: 90°
• β: 91.71 ± 0.002°
• γ: 90°
• Cell volume: 2622.8 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1115
• Residual factor for significantly intense reflections: 0.0507
• Weighted residual factors for significantly intense reflections: 0.1096
• Weighted residual factors for all reflections included in the refinement: 0.1317
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 4338557
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No