Information card for entry 1518757

Structure parameters

• Formula: C19 H27 B F3 Li N2 O5 S
• Calculated formula: C19 H27 B F3 Li N2 O5 S
• Title of publication: Diverse reactivity of a tricoordinate organoboron L2PhB: (L = oxazol-2-ylidene) towards alkali metal, group 9 metal, and coinage metal precursors
• Authors of publication: Kong, Lingbing; Ganguly, Rakesh; Li, Yongxin; Kinjo, Rei
• Journal of publication: Chem. Sci.
• Year of publication: 2015
• Journal volume: 6
• Journal issue: 5
• Pages of publication: 2893
• a: 5.9513 ± 0.0006 Å
• b: 10.9562 ± 0.0011 Å
• c: 17.3953 ± 0.0015 Å
• α: 96.176 ± 0.005°
• β: 93.242 ± 0.005°
• γ: 97.646 ± 0.006°
• Cell volume: 1114.73 ± 0.19 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1713
• Residual factor for significantly intense reflections: 0.0685
• Weighted residual factors for significantly intense reflections: 0.1112
• Weighted residual factors for all reflections included in the refinement: 0.1408
• Goodness-of-fit parameter for all reflections included in the refinement: 0.996
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No