Information card for entry 4078940

Structure parameters

• Formula: C44 H39 B Cl2 F4 O3 P2 Pt
• Calculated formula: C44 H39 B Cl2 F4 O3 P2 Pt
• Title of publication: η3-Furfuryl and η3-Thienyl Complexes of Palladium and Platinum of Relevance to the Functionalization of Biomass-Derived Furans
• Authors of publication: Shi, Yang; Brenner, Peter; Bertsch, Stefanie; Radacki, Krzysztof; Dewhurst, Rian D.
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 15
• Pages of publication: 5599
• a: 10.667 ± 0.008 Å
• b: 12.393 ± 0.009 Å
• c: 17.272 ± 0.013 Å
• α: 74.868 ± 0.011°
• β: 76.251 ± 0.011°
• γ: 77.722 ± 0.011°
• Cell volume: 2113 ± 3 ų
• Cell temperature: 174 ± 2 K
• Ambient diffraction temperature: 174 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0383
• Residual factor for significantly intense reflections: 0.0326
• Weighted residual factors for significantly intense reflections: 0.0784
• Weighted residual factors for all reflections included in the refinement: 0.081
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No