Information card for entry 4077867

Structure parameters

• Formula: C43 H39 As F6 O1.5 P2
• Calculated formula: C41 H35 As F6 O P2
• Title of publication: Phosphine Complexes of an Enantiomerically Pure, Atropisomeric Arsenium Ion
• Authors of publication: Kilah, Nathan L.; Wild, S. Bruce
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 7
• Pages of publication: 2658
• a: 18.723 ± 0.0004 Å
• b: 18.723 ± 0.0004 Å
• c: 23.0827 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8091.7 ± 0.3 ų
• Cell temperature: 200 K
• Ambient diffraction temperature: 200 K
• Number of distinct elements: 6
• Space group number: 96
• Hermann-Mauguin space group symbol: P 43 21 2
• Hall space group symbol: P 4nw 2abw
• Residual factor for all reflections: 0.1207
• Residual factor for significantly intense reflections: 0.0389
• Weighted residual factors for all reflections: 0.0584
• Weighted residual factors for significantly intense reflections: 0.0412
• Weighted residual factors for all reflections included in the refinement: 0.0412
• Goodness-of-fit parameter for all reflections included in the refinement: 0.8645
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No