Information card for entry 4081157

Structure parameters

• Formula: C34.5 H28.5 Cl6 N3 O6 Rh2 S2
• Calculated formula: C34.5 H28.5 Cl6 N3 O6 Rh2 S2
• Title of publication: Cyclometalation of Anthyridine-Based Ligands with Dirhodium Acetates: Structure and Catalytic Activity
• Authors of publication: Huang, Da-wei; Lo, Ying-Hao; Liu, Yi-Hung; Peng, Shie-Ming; Liu, Shiuh-Tzung
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 14
• Pages of publication: 4009
• a: 12.4138 ± 0.0003 Å
• b: 12.6953 ± 0.0003 Å
• c: 15.1813 ± 0.0004 Å
• α: 99.515 ± 0.002°
• β: 98.669 ± 0.002°
• γ: 115.686 ± 0.002°
• Cell volume: 2058.81 ± 0.1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0958
• Residual factor for significantly intense reflections: 0.0597
• Weighted residual factors for significantly intense reflections: 0.1563
• Weighted residual factors for all reflections included in the refinement: 0.1838
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No