Information card for entry 7131448

Structure parameters

• Formula: C54 H46 B Cr F21 Fe P5
• Calculated formula: C54 H46 B Cr F21 Fe P5
• Title of publication: Teaching old tricks to new dogs - rational synthesis of multi-decker complexes featuring <i>cyclo</i>-P₅ decks.
• Authors of publication: Riesinger, Christoph; Röhner, David; Krossing, Ingo; Scheer, Manfred
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2023
• Journal volume: 59
• Journal issue: 30
• Pages of publication: 4495 - 4498
• a: 15.7984 ± 0.0002 Å
• b: 19.8256 ± 0.0002 Å
• c: 18.1573 ± 0.0002 Å
• α: 90°
• β: 104.257 ± 0.001°
• γ: 90°
• Cell volume: 5511.94 ± 0.11 ų
• Cell temperature: 122.99 ± 0.1 K
• Ambient diffraction temperature: 122.99 ± 0.1 K
• Number of distinct elements: 7
• 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: 0.0427
• Residual factor for significantly intense reflections: 0.0384
• Weighted residual factors for significantly intense reflections: 0.1067
• Weighted residual factors for all reflections included in the refinement: 0.1114
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No