Information card for entry 4082867

Structure parameters

• Formula: C48 H38 Fe O4 Si2
• Calculated formula: C48 H38 Fe O4 Si2
• Title of publication: Synthesis of Fe‒H/Si‒H and Fe‒H/Ge‒H Bifunctional Complexes and Their Catalytic Hydrogenation Reactions toward Nonpolar Unsaturated Organic Molecules
• Authors of publication: Kamitani, Masahiro; Nishiguchi, Yoshinori; Tada, Ryosuke; Itazaki, Masumi; Nakazawa, Hiroshi
• Journal of publication: Organometallics
• Year of publication: 2014
• Journal volume: 33
• Journal issue: 7
• Pages of publication: 1532
• a: 14.062 ± 0.003 Å
• b: 15.879 ± 0.004 Å
• c: 20.468 ± 0.006 Å
• α: 89.243 ± 0.009°
• β: 71.201 ± 0.007°
• γ: 67.55 ± 0.007°
• Cell volume: 3967 ± 1.8 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0916
• Residual factor for significantly intense reflections: 0.0591
• Weighted residual factors for significantly intense reflections: 0.1361
• Weighted residual factors for all reflections included in the refinement: 0.1485
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No