Information card for entry 4075340

Structure parameters

• Formula: C90 H106 Cl2 O4 P4 Rh2 S2
• Calculated formula: C90 H106 Cl2 O4 P4 Rh2 S2
• SMILES: c1c(ccc(c1)[S]1CC[P](c2ccccc2)(c2ccccc2)[Rh]1([P](CCOc1c(c(cc(c1C)C)C)C)(c1ccccc1)c1ccccc1)Cl)[S]1CC[P](c2ccccc2)(c2ccccc2)[Rh]1([P](CCOc1c(C)c(cc(c1C)C)C)(c1ccccc1)c1ccccc1)Cl.O(CC)CC.O(CC)CC
• Title of publication: Triple-Decker Complexes Formed via the Weak Link Approach.
• Authors of publication: Jeon, You-Moon; Heo, Jungseok; Brown, Aaron M.; Mirkin, Chad A.
• Journal of publication: Organometallics
• Year of publication: 2006
• Journal volume: 25
• Journal issue: 11
• Pages of publication: 2729 - 2732
• a: 17.497 ± 0.005 Å
• b: 14.53 ± 0.004 Å
• c: 16.851 ± 0.005 Å
• α: 90°
• β: 104.004 ± 0.005°
• γ: 90°
• Cell volume: 4157 ± 2 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 7
• 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: 0.0803
• Residual factor for significantly intense reflections: 0.0443
• Weighted residual factors for significantly intense reflections: 0.1077
• Weighted residual factors for all reflections included in the refinement: 0.1267
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No