Information card for entry 7025817

Structure parameters

• Formula: C45 H37 Cl5 O4 P2 Rh2
• Calculated formula: C45 H37 Cl5 O4 P2 Rh2
• SMILES: [Rh]12([Cl][Rh]([Cl]2)([P](c2cc(cc3C4(C(Oc5c([P]1(c1ccccc1)c1ccccc1)cc(cc45)C)(Oc23)C)C)C)(c1ccccc1)c1ccccc1)C#[O])C#[O].C(Cl)(Cl)Cl
• Title of publication: An approach to bimetallic catalysts by ligand design.
• Authors of publication: López-Valbuena, Josep M; Escudero-Adan, Eduardo C; Benet-Buchholz, Jordi; Freixa, Zoraida; van Leeuwen, Piet W. N. M.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 36
• Pages of publication: 8560 - 8574
• a: 11.2602 ± 0.0016 Å
• b: 14.114 ± 0.004 Å
• c: 14.469 ± 0.002 Å
• α: 87.046 ± 0.01°
• β: 76.892 ± 0.008°
• γ: 79.328 ± 0.009°
• Cell volume: 2200.7 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0609
• Residual factor for significantly intense reflections: 0.0499
• Weighted residual factors for significantly intense reflections: 0.1327
• Weighted residual factors for all reflections included in the refinement: 0.1473
• Goodness-of-fit parameter for all reflections included in the refinement: 1.049
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No