Information card for entry 7124446

Structure parameters

• Formula: C87 H67 B Cl4 F24 Mn N O P4
• Calculated formula: C87 H67 B Cl4 F24 Mn N O P4
• Title of publication: Triple Hydrogen Atom Abstraction from Mn-NH3 Complexes Results in Cyclophosphazenium Cations
• Authors of publication: Cook, Brian J.; Johnson, Samantha I.; Chambers, Geoffrey M.; Kaminsky, Werner; Bullock, R. Morris
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 13.128 ± 0.005 Å
• b: 18.154 ± 0.006 Å
• c: 18.203 ± 0.006 Å
• α: 96.069 ± 0.012°
• β: 92.463 ± 0.014°
• γ: 99.009 ± 0.015°
• Cell volume: 4253 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 9
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0656
• Residual factor for significantly intense reflections: 0.0537
• Weighted residual factors for significantly intense reflections: 0.1273
• Weighted residual factors for all reflections included in the refinement: 0.1379
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No