Information card for entry 1577313

Structure parameters

• Formula: C36 H64 Cl2 F3 N4 O3 P3 S
• Calculated formula: C36 H64 Cl2 F3 N4 O3 P3 S
• 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: 17.24 ± 0.0001 Å
• b: 14.5891 ± 0.0001 Å
• c: 17.7842 ± 0.0002 Å
• α: 90°
• β: 96.179 ± 0.001°
• γ: 90°
• Cell volume: 4447.03 ± 0.06 ų
• Cell temperature: 100.01 ± 0.1 K
• Ambient diffraction temperature: 100.01 ± 0.1 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: 0.0546
• Residual factor for significantly intense reflections: 0.053
• Weighted residual factors for significantly intense reflections: 0.1423
• Weighted residual factors for all reflections included in the refinement: 0.1442
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No