Information card for entry 7007795

Structure parameters

• Formula: C41 H43 Cl2 Fe N O7 P2 Pd Si
• Calculated formula: C41 H43 Cl2 Fe N O7 P2 Pd Si
• SMILES: [Pd]12([Fe]([P](c3ccccc3)(c3ccccc3)C[P]1(c1ccccc1)c1ccccc1)([Si]([O]2C)(OC)OC)(C#[O])(C#[O])C#[O])C(=N\c1ccccc1OC)/C.ClCCl
• Title of publication: Insertion reactions of alkynes and organic isocyanides into the palladium-carbon bond of dimetallic Fe-Pd alkoxysilyl complexes.
• Authors of publication: Knorr, Michael; Jourdain, Isabelle; Braunstein, Pierre; Strohmann, Carsten; Tiripicchio, Antonio; Ugozzoli, Franco
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 44
• Pages of publication: 5248 - 5258
• a: 10.88 ± 0.013 Å
• b: 26.56 ± 0.03 Å
• c: 15.165 ± 0.016 Å
• α: 90°
• β: 96.77 ± 0.09°
• γ: 90°
• Cell volume: 4352 ± 9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 9
• 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: 0.1608
• Residual factor for significantly intense reflections: 0.0616
• Weighted residual factors for significantly intense reflections: 0.1319
• Weighted residual factors for all reflections included in the refinement: 0.1657
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation probe: x-ray
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No