Information card for entry 4078705

Structure parameters

• Formula: C93 H94 Cl2 P4 Ru2 S2
• Calculated formula: C93 H94 Cl2 P4 Ru2 S2
• Title of publication: Synthesis and Characterization of Dithia[3.3]paracyclophane-Bridged Binuclear Ruthenium Vinyl and Alkynyl Complexes
• Authors of publication: Xia, Jian-Long; Man, Wing Y.; Zhu, Xinxun; Zhang, Chan; Jin, Guo-Jun; Schauer, Phil A.; Fox, Mark A.; Yin, Jun; Yu, Guang-Ao; Low, Paul J.; Liu, Sheng Hua
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 15
• Pages of publication: 5321
• a: 20.4758 ± 0.0012 Å
• b: 30.847 ± 0.0018 Å
• c: 13.1932 ± 0.0007 Å
• α: 90°
• β: 96.847 ± 0.001°
• γ: 90°
• Cell volume: 8273.6 ± 0.8 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• 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: 0.0687
• Residual factor for significantly intense reflections: 0.0609
• Weighted residual factors for significantly intense reflections: 0.1418
• Weighted residual factors for all reflections included in the refinement: 0.1459
• Goodness-of-fit parameter for all reflections included in the refinement: 1.149
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No