Information card for entry 4066891

Structure parameters

• Formula: C128 H220 Cs2 N4 O26 P6
• Calculated formula: C128 H220 Cs2 N4 O26 P6
• Title of publication: Fragmentation of an N-Substituted One-Coordinate Phosphorus (Phosphaalkyne): Plausible Generation of Monovalent Phosphorus Species†
• Authors of publication: Ionkin, Alex S.; Marshall, William J.; Fish, Brian M.; Howe, Laurie A.
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 18
• Pages of publication: 4154
• a: 14.607 ± 0.004 Å
• b: 21.454 ± 0.006 Å
• c: 23.662 ± 0.007 Å
• α: 92.847 ± 0.007°
• β: 91.262 ± 0.007°
• γ: 103.893 ± 0.007°
• Cell volume: 7185 ± 4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.1833
• Residual factor for significantly intense reflections: 0.0841
• Weighted residual factors for significantly intense reflections: 0.1986
• Weighted residual factors for all reflections included in the refinement: 0.2434
• Goodness-of-fit parameter for all reflections included in the refinement: 0.965
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No