Information card for entry 7024019

Structure parameters

• Formula: C22 H32 Fe O2 Si4
• Calculated formula: C22 H32 Fe O2 Si4
• SMILES: [Fe]12([Si](c3ccccc3[Si]1(C)C)(C)C)([Si](c1ccccc1[Si]2(C)C)(C)C)(C#[O])C#[O]
• Title of publication: Catalyst design for iron-promoted reductions: an iron disilyl-dicarbonyl complex bearing weakly coordinating η(2)-(H-Si) moieties.
• Authors of publication: Sunada, Yusuke; Tsutsumi, Hironori; Shigeta, Keisuke; Yoshida, Ryota; Hashimoto, Toru; Nagashima, Hideo
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 48
• Pages of publication: 16687 - 16692
• a: 17.122 ± 0.003 Å
• b: 16.141 ± 0.002 Å
• c: 9.4508 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2611.9 ± 0.7 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for significantly intense reflections: 0.0558
• Weighted residual factors for all reflections included in the refinement: 0.1434
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No