Information card for entry 7717955

Structure parameters

• Formula: C55 H66 Cu F3 N4 O5 P2 S3
• Calculated formula: C55 H66 Cu F3 N4 O5 P2 S3
• Title of publication: Phosphine/sulfoxide-carbone, a ligand with a flexible bonding mode for early to late transition metals.
• Authors of publication: Hameury, Sophie; Bousquet, Laura; Saffon-Merceron, Nathalie; Baceiredo, Antoine; Madec, David; Maerten, Eddy
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 10
• Pages of publication: 4142 - 4150
• a: 10.9404 ± 0.0003 Å
• b: 15.3548 ± 0.0005 Å
• c: 17.1108 ± 0.0005 Å
• α: 93.6895 ± 0.0012°
• β: 95.1242 ± 0.0011°
• γ: 99.2602 ± 0.0011°
• Cell volume: 2816.53 ± 0.15 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0842
• Residual factor for significantly intense reflections: 0.0484
• Weighted residual factors for significantly intense reflections: 0.1107
• Weighted residual factors for all reflections included in the refinement: 0.1304
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No