Information card for entry 4310681

Structure parameters

• Formula: C71 H76 Cl6 N6 O10 Ru3
• Calculated formula: C71 H62 Cl6 N6 O10 Ru3
• Title of publication: Diastereoselective Formation of Metallamacrocyclic (Arene)RuII and Cp*RhIII Complexes
• Authors of publication: Marie-Line Lehaire; Rosario Scopelliti; Lorenz Herdeis; Kurt Polborn; Peter Mayer; Kay Severin
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 1609 - 1617
• a: 17.0208 ± 0.0019 Å
• b: 17.3799 ± 0.0017 Å
• c: 24.39 ± 0.003 Å
• α: 90°
• β: 97.174 ± 0.009°
• γ: 90°
• Cell volume: 7158.6 ± 1.4 ų
• Cell temperature: 140 ± 2 K
• Ambient diffraction temperature: 140 ± 2 K
• Number of distinct elements: 6
• Space group number: 9
• Hermann-Mauguin space group symbol: I 1 a 1
• Hall space group symbol: I -2ya
• Residual factor for all reflections: 0.1394
• Residual factor for significantly intense reflections: 0.0735
• Weighted residual factors for significantly intense reflections: 0.1613
• Weighted residual factors for all reflections included in the refinement: 0.1864
• Goodness-of-fit parameter for all reflections included in the refinement: 0.792
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No