Information card for entry 4335689

Structure parameters

• Formula: C33 H35 B F14 N P2
• Calculated formula: C33 H35 B F14 N P2
• Title of publication: NH/PH Isomerization and a Lewis Pair for Carbon Dioxide Capture
• Authors of publication: Brian M. Barry; Diane A. Dickie; Luke J. Murphy; Jason A. C. Clyburne; Richard A. Kemp
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 8312 - 8314
• a: 9.9153 ± 0.0015 Å
• b: 13.034 ± 0.002 Å
• c: 13.889 ± 0.002 Å
• α: 86.354 ± 0.008°
• β: 80.955 ± 0.008°
• γ: 74.527 ± 0.008°
• Cell volume: 1707.9 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0765
• Residual factor for significantly intense reflections: 0.0515
• Weighted residual factors for significantly intense reflections: 0.1445
• Weighted residual factors for all reflections included in the refinement: 0.1624
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No