Information card for entry 7131936

Structure parameters

• Formula: C47.01 H39 Al F36.01 O6 P5 Ta
• Calculated formula: C47 H39 Al F36 O6 P5 Ta
• Title of publication: Ring Expansion vs. Addition – Reactivity of a cyclo-P4 Complex Towards Pnictogenium Cations
• Authors of publication: Riesinger, Christoph; Erhard, Alexander; Scheer, Manfred
• Journal of publication: Chemical Communications
• Year of publication: 2023
• a: 14.9785 ± 0.0003 Å
• b: 15.3177 ± 0.0003 Å
• c: 15.6939 ± 0.0003 Å
• α: 95.299 ± 0.002°
• β: 108.4 ± 0.002°
• γ: 110.628 ± 0.002°
• Cell volume: 3112.48 ± 0.13 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0389
• Residual factor for significantly intense reflections: 0.0358
• Weighted residual factors for significantly intense reflections: 0.0929
• Weighted residual factors for all reflections included in the refinement: 0.0953
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No