Information card for entry 7044758

Structure parameters

• Formula: C34 H45 B2 F8 N4 P
• Calculated formula: C34 H45 B2 F8 N4 P
• Title of publication: Dicationic phosphonium salts: Lewis acid initiators for the Mukaiyama-aldol reaction
• Authors of publication: Barrado, Alejandro G.; Bayne, Julia M.; Johnstone, Timothy C.; Lehmann, Christian W.; Stephan, Douglas W.; Alcarazo, Manuel
• Journal of publication: Dalton Transactions
• Year of publication: 2017
• a: 10.7253 ± 0.0019 Å
• b: 18.314 ± 0.003 Å
• c: 20.167 ± 0.004 Å
• α: 113.338 ± 0.003°
• β: 90.98 ± 0.003°
• γ: 93.392 ± 0.003°
• Cell volume: 3627.2 ± 1.1 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1138
• Residual factor for significantly intense reflections: 0.0829
• Weighted residual factors for significantly intense reflections: 0.2185
• Weighted residual factors for all reflections included in the refinement: 0.2454
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No