Information card for entry 1518755

Structure parameters

• Formula: C18 H27 Au B Cl N2 O2
• Calculated formula: C18 H27 Au B Cl N2 O2
• SMILES: [Au]([B](C1=[N](C)C(C)(C)CO1)(C1=[N](C)C(C)(C)CO1)c1ccccc1)Cl
• 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: 11.295 ± 0.0011 Å
• b: 10.512 ± 0.0008 Å
• c: 16.9583 ± 0.0016 Å
• α: 90°
• β: 102.328 ± 0.004°
• γ: 90°
• Cell volume: 1967.1 ± 0.3 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0456
• Residual factor for significantly intense reflections: 0.0378
• Weighted residual factors for significantly intense reflections: 0.1144
• Weighted residual factors for all reflections included in the refinement: 0.1298
• Goodness-of-fit parameter for all reflections included in the refinement: 1.151
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No