Information card for entry 7239218

Structure parameters

• Formula: C22 H26 F6 N5 O7 P S2
• Calculated formula: C22 H26 F6 N5 O7 P S2
• Title of publication: P-oxidation of gem-dicationic phosphines
• Authors of publication: Maaliki, Carine; Canac, Yves; Lepetit, Christine; Duhayon, Carine; Chauvin, Remi
• Journal of publication: RSC Advances
• Year of publication: 2013
• Journal volume: 3
• Journal issue: 43
• Pages of publication: 20391
• a: 10.2649 ± 0.0003 Å
• b: 12.1611 ± 0.0004 Å
• c: 12.7816 ± 0.0004 Å
• α: 81.178 ± 0.002°
• β: 71.935 ± 0.002°
• γ: 72.878 ± 0.002°
• Cell volume: 1446.29 ± 0.08 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 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: 0.0689
• Residual factor for significantly intense reflections: 0.0418
• Weighted residual factors for all reflections: 0.0612
• Weighted residual factors for significantly intense reflections: 0.0408
• Weighted residual factors for all reflections included in the refinement: 0.0379
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1243
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No