Information card for entry 7150387

Structure parameters

• Formula: C36 H42 F6 N3 O2 P
• Calculated formula: C36 H42 F6 N3 O2 P
• Title of publication: Towards the stereoselective synthesis of inherently chiral pseudorotaxanes.
• Authors of publication: Mobian, Pierre; Banerji, Natalie; Bernardinelli, Gérald; Lacour, Jérôme
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2006
• Journal volume: 4
• Journal issue: 2
• Pages of publication: 224 - 231
• a: 16.6913 ± 0.0012 Å
• b: 13.6741 ± 0.0007 Å
• c: 15.0144 ± 0.0009 Å
• α: 90°
• β: 91.6 ± 0.008°
• γ: 90°
• Cell volume: 3425.5 ± 0.4 ų
• Cell temperature: 200 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.042
• Weighted residual factors for all reflections included in the refinement: 0.037
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No