Information card for entry 4305469

Structure parameters

• Formula: C23 H38 Rh2 S2
• Calculated formula: C23 H38 Rh2 S2
• SMILES: [Rh]1234([S]5[Rh]678([S]1C5(C(C)C)C(C)C)[CH]1=[CH]7CC[CH]8=[CH]6CC1)[CH]1=[CH]3CC[CH]4=[CH]2CC1
• Title of publication: Synthesis, Structural Characterization, and Ligand Replacement Reactions of gem-Dithiolato-Bridged Rhodium and Iridium Complexes
• Authors of publication: Angel B. Rivas; José M. Gascón; Fernando J. Lahoz; Ana I. Balana; Alvaro J. Pardey; Luis A. Oro; Jesús J. Pérez-Torrente
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 6090 - 6104
• a: 6.4559 ± 0.0004 Å
• b: 10.802 ± 0.0006 Å
• c: 16.8466 ± 0.001 Å
• α: 99.427 ± 0.001°
• β: 91.151 ± 0.001°
• γ: 104.99 ± 0.001°
• Cell volume: 1117.11 ± 0.11 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.028
• Residual factor for significantly intense reflections: 0.0231
• Weighted residual factors for significantly intense reflections: 0.0495
• Weighted residual factors for all reflections included in the refinement: 0.0511
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No