Information card for entry 7025362

Structure parameters

• Formula: C26 H29 Cl2 N2 O2 P2 Pd Re
• Calculated formula: C26 H29 Cl2 N2 O2 P2 Pd Re
• SMILES: [Re]12345([Pd](Cl)([P]([c]62[cH]1[cH]4[cH]5[cH]36)(c1ccccc1)c1ccccc1)Cl)(C#[O])(C#[O])[P](C)(C)C.C(#N)C.CC#N
• Title of publication: Heterobimetallic Re=Pd complexes bridged by eta(1):eta(5)-Ph(2)PC(5)H(4) ligand. Synthesis, electronic and crystal structure of (CO)(2)(PR(3))(eta(5)-C(5)H(4)PPh(2))Re-PdCl(2), R = Me and OMe.
• Authors of publication: Sierra, Diego; Klahn, A. Hugo; Ramirez-Tagle, Rodrigo; Arratia-Perez, Ramiro; Godoy, Fernando; Teresa Garland, Maria; Fuentealba, Mauricio
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 27
• Pages of publication: 6295 - 6301
• a: 16.853 ± 0.002 Å
• b: 17.329 ± 0.002 Å
• c: 10.1789 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2972.7 ± 0.6 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 8
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0969
• Residual factor for significantly intense reflections: 0.0692
• Weighted residual factors for significantly intense reflections: 0.1255
• Weighted residual factors for all reflections included in the refinement: 0.1358
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No