Information card for entry 1506895

Structure parameters

• Formula: C33.5 H45 Cl5 P2 Pd S
• Calculated formula: C33.5 H44 Cl5 P2 Pd S
• Title of publication: Preparation and coordination properties including catalytic activities of a bulky 2-methyl-3-thioxo-1,3-diphosphapropene.
• Authors of publication: Liang, Hongze; Ito, Shigekazu; Yoshifuji, Masaaki
• Journal of publication: Organic letters
• Year of publication: 2004
• Journal volume: 6
• Journal issue: 3
• Pages of publication: 425 - 427
• a: 13.0619 ± 0.0009 Å
• b: 14.127 ± 0.002 Å
• c: 11.692 ± 0.001 Å
• α: 108.13 ± 0.01°
• β: 109.703 ± 0.005°
• γ: 77.28 ± 0.02°
• Cell volume: 1914.2 ± 0.4 ų
• Cell temperature: 296.2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0618
• Weighted residual factors for all reflections included in the refinement: 0.1631
• Goodness-of-fit parameter for all reflections included in the refinement: 1.571
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No