Information card for entry 7051485

Structure parameters

• Formula: C43 H46 Cl4 Fe N2 O10 P2 Pd Si
• Calculated formula: C43 H46 Cl4 Fe N2 O10 P2 Pd Si
• SMILES: [Pd]123([Fe]([P](N[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)([Si](OC)(OC)[O]3C)(C#[O])(C#[O])C2=O)[C@H]1[C@H]([C@H]2O[C@@H]1[C@@](OC(=O)C)(C2)C#N)C(=O)C.ClCCl.ClCCl.[Pd]123([Fe]([P](N[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)([Si](OC)(OC)[O]3C)(C#[O])(C#[O])C2=O)[C@@H]1[C@@H]([C@@H]2O[C@H]1[C@](OC(=O)C)(C2)C#N)C(=O)C.ClCCl.ClCCl
• Journal of publication: New Journal of Chemistry
• Year of publication: 1999
• a: 11.057 ± 0.002 Å
• b: 26.977 ± 0.005 Å
• c: 17.087 ± 0.003 Å
• α: 90°
• β: 104.63 ± 0.03°
• γ: 90°
• Cell volume: 4931.5 ± 1.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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 significantly intense reflections: 0.0577
• Weighted residual factors for significantly intense reflections: 0.1572
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No