Information card for entry 4086447

Structure parameters

• Common name: KM3-Pd
• Formula: C33.33 H55.33 Cl5.98 P2 Pd
• Calculated formula: C33.327 H55.327 Cl5.981 P2 Pd
• Title of publication: Streamlined Preparation and Coordination Chemistry of Hybrid Phosphine‒Phosphaalkene Ligands
• Authors of publication: Magnuson, Kevin W.; Oshiro, Shelly M.; Gurr, Joshua R.; Yoshida, Wesley Y.; Gembicky, Milan; Rheingold, Arnold L.; Hughes, Russell P.; Cain, Matthew F.
• Journal of publication: Organometallics
• Year of publication: 2016
• Journal volume: 35
• Journal issue: 6
• Pages of publication: 855 - 859
• a: 14.5058 ± 0.0006 Å
• b: 15.1344 ± 0.0007 Å
• c: 19.3313 ± 0.0011 Å
• α: 90°
• β: 106.901 ± 0.003°
• γ: 90°
• Cell volume: 4060.6 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100.15 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: 0.1092
• Residual factor for significantly intense reflections: 0.0637
• Weighted residual factors for significantly intense reflections: 0.1498
• Weighted residual factors for all reflections included in the refinement: 0.1755
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No