Information card for entry 7009152

Structure parameters

• Formula: C22 H24 O3 P2
• Calculated formula: C22 H24 O3 P2
• SMILES: P(=O)(OCC)(OCC)c1c(P(c2ccccc2)c2ccccc2)cccc1
• Title of publication: Platinum(II), palladium(II) and rhodium(I) complexes of o-, m- and p-Ph2PC6H4PO(OEt)2. PtCl2‒SnCl2 Hydroformylation catalysts modified with phosphonated triarylphosphines
• Authors of publication: Dianne D. Ellis; Gayle Harrison; A. Guy Orpen; Hirihattaya Phetmung; Paul G. Pringle; Johannes G. deVries; Henk Oevering
• Journal of publication: J. Chem. Soc., Dalton Trans.
• Year of publication: 2000
• Journal issue: 5
• Pages of publication: 671 - 675
• a: 8.5253 ± 0.0012 Å
• b: 9.4993 ± 0.0017 Å
• c: 25.999 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2105.5 ± 0.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0605
• Residual factor for significantly intense reflections: 0.0485
• Weighted residual factors for significantly intense reflections: 0.1163
• Weighted residual factors for all reflections included in the refinement: 0.128
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No