Information card for entry 4074105

Structure parameters

• Formula: C72 H43 Cl12 F3 N8 Ru2
• Calculated formula: C72 H43 Cl12.03 F3 N8 Ru2
• Title of publication: Negishi CouplingExpedient Formation of Biphenyls on the Periphery of Inorganic/Organometallic Diruthenium Species
• Authors of publication: Zhang, Lei; Huang, Zhihong; Chen, Wei-Zhong; Negishi, Ei-ichi; Fanwick, Phillip E.; Updegraff, James B.; Protasiewicz, John D.; Ren, Tong
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 26
• Pages of publication: 6526
• a: 14.408 ± 0.006 Å
• b: 24.52 ± 0.009 Å
• c: 24.802 ± 0.01 Å
• α: 90°
• β: 98.012 ± 0.005°
• γ: 90°
• Cell volume: 8677 ± 6 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1105
• Residual factor for significantly intense reflections: 0.0657
• Weighted residual factors for significantly intense reflections: 0.1639
• Weighted residual factors for all reflections included in the refinement: 0.1806
• Goodness-of-fit parameter for all reflections included in the refinement: 1.102
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No