Information card for entry 4064023

Structure parameters

• Formula: C18 H29 Cl5 P2 Pt
• Calculated formula: C18 H29 Cl5 P2 Pt
• SMILES: [Pt]1([P](CC)(CC)CC)([P](C1C)(CC)CC)c1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl
• Title of publication: Pt(PEt3)(κ2-P,C-PEt2CHMe)(C6Cl5): An Unexpected Intermediate in the Synthesis ofcis-Pt(PEt3)2(Cl)(C6Cl5)
• Authors of publication: Robinson, Robert; Clarkson, Joseph M.; Moody, Morgan A.; Sharp, Paul R.
• Journal of publication: Organometallics
• Year of publication: 2011
• Journal volume: 30
• Journal issue: 6
• Pages of publication: 1730
• a: 8.356 ± 0.004 Å
• b: 9.736 ± 0.005 Å
• c: 15.204 ± 0.008 Å
• α: 78.199 ± 0.006°
• β: 88.38 ± 0.006°
• γ: 88.251 ± 0.006°
• Cell volume: 1209.9 ± 1.1 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: 0.0316
• Residual factor for significantly intense reflections: 0.0267
• Weighted residual factors for significantly intense reflections: 0.062
• Weighted residual factors for all reflections included in the refinement: 0.0654
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No