Information card for entry 1577312

Structure parameters

• Formula: C76 H88 Cl8 F6 N4 O6 P4 Pd2 S2
• Calculated formula: C76 H88 Cl8 F6 N4 O6 P4 Pd2 S2
• Title of publication: Imidazoliumyl-Substituted Di-and Iso-Tetraphosphanes and Their Metal-Mediated Fragmentation Reactions
• Authors of publication: Fidelius, Jannis; Taube, Clemens; Schwedtmann, Kai; Hennersdorf, Felix; Gomila, Rosa Maria; Frontera, Antonio; Wolf, Robert; Weigand, Jan J.
• Journal of publication: Chemical Science
• Year of publication: 2026
• a: 14.2227 ± 0.0002 Å
• b: 17.6707 ± 0.0001 Å
• c: 18.9439 ± 0.0001 Å
• α: 100.773 ± 0.001°
• β: 96.85 ± 0.001°
• γ: 108.284 ± 0.001°
• Cell volume: 4359.5 ± 0.08 ų
• Cell temperature: 100.01 ± 0.1 K
• Ambient diffraction temperature: 100.01 ± 0.1 K
• Number of distinct elements: 9
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0412
• Residual factor for significantly intense reflections: 0.0392
• Weighted residual factors for significantly intense reflections: 0.1077
• Weighted residual factors for all reflections included in the refinement: 0.1098
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No