Information card for entry 7706317

Structure parameters

• Formula: C43 H77 I N P3 Pd2
• Calculated formula: C43 H77 I N P3 Pd2
• Title of publication: P-Alkynyl functionalized benzazaphospholes as transmetalating agents.
• Authors of publication: Zhou, Daniel Y.; Miura-Akagi, Preston M; McCarty, Sierra M.; Guiles, Celeste H.; O'Donnell, Timothy J; Yoshida, Wesley Y.; Krause, Colleen E.; Rheingold, Arnold L.; Hughes, Russell P.; Cain, Matthew F.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 2
• Pages of publication: 599 - 611
• a: 13.661 ± 0.0002 Å
• b: 23.3921 ± 0.0003 Å
• c: 15.1918 ± 0.0002 Å
• α: 90°
• β: 106.894 ± 0.001°
• γ: 90°
• Cell volume: 4645.18 ± 0.11 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0399
• Residual factor for significantly intense reflections: 0.0313
• Weighted residual factors for significantly intense reflections: 0.0712
• Weighted residual factors for all reflections included in the refinement: 0.0769
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No