Information card for entry 7122810

Structure parameters

• Formula: C71 H66 F6 N2 O6 P4 Rh2 S2
• Calculated formula: C71 H66 F6 N2 O6 P4 Rh2 S2
• Title of publication: Halogenation of A-Frame μ-Carbido Complexes: Synthesis of η2-Halocarbynes
• Authors of publication: Hill, Anthony; Barnett, Harrison J.
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 11.7284 ± 0.0003 Å
• b: 23.9123 ± 0.0007 Å
• c: 12.042 ± 0.0003 Å
• α: 90°
• β: 93.506 ± 0.003°
• γ: 90°
• Cell volume: 3370.89 ± 0.16 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 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: 0.1061
• Residual factor for significantly intense reflections: 0.0982
• Weighted residual factors for significantly intense reflections: 0.2618
• Weighted residual factors for all reflections included in the refinement: 0.2702
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No