Information card for entry 7128927

Structure parameters

• Formula: C31 H34 Cl2 N3 O3 P Pd
• Calculated formula: C31 H34 Cl2 N3 O3 P Pd
• Title of publication: Construction of modular Pd/Cu multimetallic chains via ligand- and anion-controlled metal-metal interactions
• Authors of publication: Rivada Wheelaghan, Orestes; Deolka, Shubham; Govindarajan, Ramadoss; Khaskin, Eugene; Fayzullin, Robert R.; Pal, Shrinwantu; Khusnutdinova, Julia R.
• Journal of publication: Chemical Communications
• Year of publication: 2021
• a: 7.78647 ± 0.00004 Å
• b: 13.20388 ± 0.00005 Å
• c: 15.31398 ± 0.00007 Å
• α: 90°
• β: 104.07 ± 0.0005°
• γ: 90°
• Cell volume: 1527.22 ± 0.012 ų
• Cell temperature: 94 ± 2 K
• Ambient diffraction temperature: 94 ± 2 K
• Number of distinct elements: 7
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 c 1
• Hall space group symbol: P -2yc
• Residual factor for all reflections: 0.0323
• Residual factor for significantly intense reflections: 0.032
• Weighted residual factors for significantly intense reflections: 0.0876
• Weighted residual factors for all reflections included in the refinement: 0.0878
• Goodness-of-fit parameter for all reflections included in the refinement: 1.144
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No