Information card for entry 4077514

Structure parameters

• Formula: C26 H42 F6 Fe P4
• Calculated formula: C26 H42 F6 Fe P4
• Title of publication: A New Nine-Membered Triphosphorus Macrocycle
• Authors of publication: Edwards, Peter G.; Whatton, Mark L.; Haigh, Robert
• Journal of publication: Organometallics
• Year of publication: 2000
• Journal volume: 19
• Journal issue: 14
• Pages of publication: 2652
• a: 13.584 ± 0.003 Å
• b: 13.527 ± 0.003 Å
• c: 17.136 ± 0.003 Å
• α: 90°
• β: 109.18 ± 0.03°
• γ: 90°
• Cell volume: 2974 ± 1.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 n 1
• Hall space group symbol: P -2yac
• Residual factor for all reflections: 0.0652
• Residual factor for significantly intense reflections: 0.0598
• Weighted residual factors for significantly intense reflections: 0.1623
• Weighted residual factors for all reflections included in the refinement: 0.1737
• Goodness-of-fit parameter for all reflections included in the refinement: 1.091
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No