Information card for entry 4066354

Structure parameters

• Common name: in manuscript 2b
• Formula: C26 H55 O2 P2 Rh
• Calculated formula: C26 H55 O2 P2 Rh
• SMILES: [Rh]12([P](C[P]1(C(C)(C)C)C(C)(C)C)(C(C)(C)C)C(C)(C)C)([CH2]=[CH]2C(=O)OC)CC(C)(C)C
• Title of publication: Neutralcis-Alkyl Olefin Rhodium(I) Complexes: Models of Intermediates in Late Transition Metal Olefin Polymerization with Surprising Structure†
• Authors of publication: Urtel, Heiko; Meier, Claudia; Rominger, Frank; Hofmann, Peter
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 21
• Pages of publication: 5496
• a: 9.0537 ± 0.0004 Å
• b: 17.0093 ± 0.0008 Å
• c: 19.0625 ± 0.0008 Å
• α: 90°
• β: 94.062 ± 0.001°
• γ: 90°
• Cell volume: 2928.2 ± 0.2 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• 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: 0.1358
• Residual factor for significantly intense reflections: 0.0707
• Weighted residual factors for significantly intense reflections: 0.168
• Weighted residual factors for all reflections included in the refinement: 0.2105
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No