Information card for entry 4078951

Structure parameters

• Chemical name: (pR*,S~S~*)-Dichloro[(1,2,3,3a,7a-η)-1-[2-(methylsulfinyl-κS)-naphthyl]- 2-methyl-1H-inden-1-yl]rhodium
• Formula: C26.45 H22.5 Cl2.1 O Rh S
• Calculated formula: C26.45 H22.5 Cl2.1 O Rh S
• Title of publication: Stereospecific Syntheses and Structures of Planar Chiral Bidentate η5:κS-Indenyl-Sulfanyl and-Sulfinyl Complexes of Rhodium(III)
• Authors of publication: Baker, Robert W.; Radzey, Hanna; Lucas, Nigel T.; Turner, Peter
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 15
• Pages of publication: 5622
• a: 14.2599 ± 0.0001 Å
• b: 21.481 ± 0.0002 Å
• c: 31.5683 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 9669.9 ± 0.15 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0391
• Residual factor for significantly intense reflections: 0.0328
• Weighted residual factors for significantly intense reflections: 0.095
• Weighted residual factors for all reflections included in the refinement: 0.1002
• Goodness-of-fit parameter for all reflections included in the refinement: 1.485
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No