Information card for entry 4069912

Structure parameters

• Formula: C40 H42 Cl4 F6 N P3 Pd Ru
• Calculated formula: C40 H42 Cl4 F6 N P3 Pd Ru
• Title of publication: Stepwise Functionalization of Two Alkyne Moieties in a Dialkynylphosphine Complex Leading to the Formation of a Bifunctionalized Phosphine Complex Bearing a Stereogenic Center at Phosphorus
• Authors of publication: Luo, Ding; Li, Yongxin; Tan, Kien-Wee; Leung, Pak-Hing
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 21
• Pages of publication: 6266
• a: 12.5082 ± 0.0004 Å
• b: 16.1261 ± 0.0005 Å
• c: 21.6743 ± 0.0007 Å
• α: 90°
• β: 99.573 ± 0.002°
• γ: 90°
• Cell volume: 4311 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 8
• 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: 0.0637
• Residual factor for significantly intense reflections: 0.0429
• Weighted residual factors for significantly intense reflections: 0.1076
• Weighted residual factors for all reflections included in the refinement: 0.124
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No