Information card for entry 7124447

Structure parameters

• Formula: C34 H24.5 B F20 N O0.25 P2
• Calculated formula: C34 H24.5 B F20 N O0.25 P2
• 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: 10.9026 ± 0.0007 Å
• b: 12.5479 ± 0.0009 Å
• c: 15.0949 ± 0.0009 Å
• α: 69.272 ± 0.004°
• β: 70.857 ± 0.004°
• γ: 78.274 ± 0.004°
• Cell volume: 1815.7 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1091
• Residual factor for significantly intense reflections: 0.0498
• Weighted residual factors for significantly intense reflections: 0.1035
• Weighted residual factors for all reflections included in the refinement: 0.1264
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No