Information card for entry 4068244

Structure parameters

• Formula: C24 H44 Fe P2 Si2
• Calculated formula: C24 H44 Fe P2 Si2
• SMILES: [Fe]12345678(P9[CH]4=[C]3([C]2(=[C]19[Si](C)(C)C(C)(C)C)C)C)P1[CH]8=[C]7([C]6(=[C]51[Si](C)(C)C(C)(C)C)C)C
• Title of publication: Concise Synthesis of Enantiopure (S)-(+)-2,2′-Bis(tert-butyldimethylsilyl)-1,1′-diphosphaferrocene: Anion-Dependence of Its Coordination to Palladium(II) Centers
• Authors of publication: Cabon, Yves; Carmichael, Duncan; Le Goff, Xavier-Frédéric
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 1
• Pages of publication: 370
• a: 7.462 ± 0.001 Å
• b: 23.903 ± 0.001 Å
• c: 16.032 ± 0.001 Å
• α: 90°
• β: 108.353 ± 0.001°
• γ: 90°
• Cell volume: 2714.1 ± 0.4 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 K
• Number of distinct elements: 5
• 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: 0.0709
• Residual factor for significantly intense reflections: 0.055
• Weighted residual factors for significantly intense reflections: 0.1349
• Weighted residual factors for all reflections included in the refinement: 0.1459
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No