Information card for entry 4069490

Structure parameters

• Formula: C18 H36 Fe Ge O Si
• Calculated formula: C18 H36 Fe Ge O Si
• SMILES: [FeH]1234([Ge](CC)(CC)CC)([Si](CC)(CC)CC)([cH]5[cH]2[cH]3[cH]4[cH]51)C#[O]
• Title of publication: Syntheses and Ligand Exchange Reaction of Iron(IV) Complexes with Two Different Group 14 Element Ligands, Cp(CO)FeH(EEt3)(E′Et3) (E, E′ = Si, Ge, Sn)
• Authors of publication: Itazaki, Masumi; Kamitani, Masahiro; Ueda, Kensuke; Nakazawa, Hiroshi
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 13
• Pages of publication: 3601
• a: 30.938 ± 0.003 Å
• b: 10.2592 ± 0.0008 Å
• c: 14.081 ± 0.0014 Å
• α: 90°
• β: 107.792 ± 0.005°
• γ: 90°
• Cell volume: 4255.5 ± 0.7 ų
• Cell temperature: 200 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0691
• Residual factor for significantly intense reflections: 0.0571
• Weighted residual factors for significantly intense reflections: 0.1014
• Weighted residual factors for all reflections included in the refinement: 0.1064
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No