Information card for entry 1518758

Structure parameters

• Formula: C26 H39 B Cl N2 O2 Rh
• Calculated formula: C26 H38.734 B Cl N2 O2 Rh
• SMILES: [Rh]123(Cl)([CH]4CC[CH]1=[CH]2CC[CH]3=4)CN1C(OCC1(C)C)=[BH](=C1OCC(N1C)(C)C)c1ccccc1
• 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: 16.46 ± 0.002 Å
• b: 13.8072 ± 0.0016 Å
• c: 11.9483 ± 0.0018 Å
• α: 90°
• β: 104.628 ± 0.009°
• γ: 90°
• Cell volume: 2627.4 ± 0.6 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103.15 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1552
• Residual factor for significantly intense reflections: 0.0886
• Weighted residual factors for significantly intense reflections: 0.1695
• Weighted residual factors for all reflections included in the refinement: 0.1934
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No