Information card for entry 4075853

Structure parameters

• Formula: C74.5 H50 Cl3 N2 O29 P2 Rh6 Ru6
• Calculated formula: C74.47 H49.93 Cl3 N2 O29 P2 Rh6 Ru6
• Title of publication: Supermolecular Assembly of Tetra- and Hexanuclear Carbonyl Clusters Using a Novel Polydentate Pyridylphosphine Ligand
• Authors of publication: Koshevoy, Igor O.; Haukka, Matti; Pakkanen, Tapani A.; Tunik, Sergey P.; Vainiotalo, Pirjo
• Journal of publication: Organometallics
• Year of publication: 2005
• Journal volume: 24
• Journal issue: 14
• Pages of publication: 3516
• a: 30.9444 ± 0.0004 Å
• b: 17.9287 ± 0.0002 Å
• c: 35.4368 ± 0.0005 Å
• α: 90°
• β: 114.522 ± 0.005°
• γ: 90°
• Cell volume: 17886.8 ± 0.8 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 8
• 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: 0.0754
• Residual factor for significantly intense reflections: 0.053
• Weighted residual factors for significantly intense reflections: 0.1326
• Weighted residual factors for all reflections included in the refinement: 0.1462
• Goodness-of-fit parameter for all reflections included in the refinement: 1.084
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No