Information card for entry 4321169

Structure parameters

• Common name: 6a
• Formula: C44 H53 F12 N2 O2 P4 Pd
• Calculated formula: C44 H53 F12 N2 O2 P4 Pd
• Title of publication: Cooperative Diastereoselectivity of Palladium- and Platinum-Promoted Intramolecular [4+2] Diels-Alder Cycloaddition Reactions of 3,4-Dimethyl-1-phenylphosphole
• Authors of publication: Kent D. Redwine; William L. Wilson; Donald G. Moses; Vincent J. Catalano; John H. Nelson
• Journal of publication: Inorganic Chemistry
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 3392 - 3402
• a: 10.384 ± 0.002 Å
• b: 11.912 ± 0.0011 Å
• c: 21.26 ± 0.002 Å
• α: 74.937 ± 0.006°
• β: 83.354 ± 0.009°
• γ: 84.189 ± 0.009°
• Cell volume: 2515.4 ± 0.6 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0832
• Residual factor for significantly intense reflections: 0.0638
• Weighted residual factors for all reflections: 0.203
• Weighted residual factors for significantly intense reflections: 0.1852
• Goodness-of-fit parameter for all reflections: 0.99
• Goodness-of-fit parameter for significantly intense reflections: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No