Information card for entry 4076278

Structure parameters

• Formula: C40 H70 Cl2 P2 Rh2
• Calculated formula: C40 H70 Cl2 P2 Rh2
• SMILES: [Rh]12([P](C(C)(C)C)(C(C)(C)C)CCc3c(cccc3C)C)([Cl][Rh]3([P](C(C)(C)C)(C(C)(C)C)CCc4c(cccc4C)C)([Cl]1)[CH2]=[CH2]3)[CH2]=[CH2]2
• Title of publication: Mono- and Dinuclear Rhodium(I) and Rhodium(III) Complexes with the Bulky Phosphine 2,6-Me2C6H3CH2CH2PtBu2, Including the First Structurally Characterized Cis-Configurated Dicarbonyl Compound,cis-[RhCl(CO)2(PR3)]
• Authors of publication: Canepa, Giuseppe; Brandt, Carsten D.; Werner, Helmut
• Journal of publication: Organometallics
• Year of publication: 2004
• Journal volume: 23
• Journal issue: 5
• Pages of publication: 1140
• a: 8.5713 ± 0.0017 Å
• b: 8.5866 ± 0.0017 Å
• c: 30.745 ± 0.006 Å
• α: 94.76 ± 0.03°
• β: 94.61 ± 0.03°
• γ: 112.88 ± 0.03°
• Cell volume: 2061.9 ± 0.9 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0587
• Residual factor for significantly intense reflections: 0.0534
• Weighted residual factors for significantly intense reflections: 0.1394
• Weighted residual factors for all reflections included in the refinement: 0.142
• Goodness-of-fit parameter for all reflections included in the refinement: 1.162
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No