Information card for entry 4087388

Structure parameters

• Formula: C51 H80 F4 N2 P4 Pd2
• Calculated formula: C51 H80 F4 N2 P4 Pd2
• Title of publication: Generation of Mono- and Bimetallic Palladium Complexes and Mechanistic Insight into an Operative Metal Ring-Walking Process
• Authors of publication: Orbach, Meital; Shankar, Sreejith; Zenkina, Olena V.; Milko, Petr; Diskin-Posner, Yael; van der Boom, Milko E.
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 6
• Pages of publication: 1098
• a: 9.0332 ± 0.0003 Å
• b: 11.0003 ± 0.0004 Å
• c: 14.6167 ± 0.0005 Å
• α: 79.223 ± 0.002°
• β: 77.307 ± 0.002°
• γ: 75.198 ± 0.002°
• Cell volume: 1356.67 ± 0.08 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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 all reflections: 0.0356
• Residual factor for significantly intense reflections: 0.0283
• Weighted residual factors for significantly intense reflections: 0.0646
• Weighted residual factors for all reflections included in the refinement: 0.0683
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No