Information card for entry 7000167

Structure parameters

• Formula: C12 H23 Cl5 P2 Pt
• Calculated formula: C12 H23 Cl5 P2 Pt
• SMILES: [Pt]1([P]2(CCCC2)CCC[P]21CCCC2)(Cl)Cl.C(Cl)(Cl)Cl
• Title of publication: Stereoelectronic effects in a homologous series of bidentate cyclic phosphines. A clear correlation of hydroformylation catalyst activity with ring size
• Authors of publication: Haddow, Mairi F.; Middleton, Ann J.; Orpen, A. Guy; Pringle, Paul G.; Papp, Rainer
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 1
• Pages of publication: 202 - 209
• a: 12.165 ± 0.002 Å
• b: 12.425 ± 0.003 Å
• c: 12.614 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1906.6 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.0199
• Residual factor for significantly intense reflections: 0.0185
• Weighted residual factors for significantly intense reflections: 0.0463
• Weighted residual factors for all reflections included in the refinement: 0.0468
• Goodness-of-fit parameter for all reflections included in the refinement: 1.136
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No