Information card for entry 7015095

Structure parameters

• Formula: C35 H32 B Cl N7 P Ru
• Calculated formula: C35 H32 B Cl N7 P Ru
• SMILES: c1ccn2[n]1[Ru]1([n]3cccn3[B]2(C)n2ccc[n]12)([N]#Cc1ccccc1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)Cl
• Title of publication: Proton-induced reactivities of ruthenium azido complexes: the first example of boron-carbon bond formation by methylene insertion into a B-H bond.
• Authors of publication: Lo, Yih-Hsing; Chen, Han-Gung; Kuo, Ting Shen
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 12
• Pages of publication: 2711 - 2715
• a: 8.2392 ± 0.0005 Å
• b: 11.7901 ± 0.0006 Å
• c: 19.4125 ± 0.0013 Å
• α: 107.116 ± 0.004°
• β: 92.05 ± 0.004°
• γ: 108.142 ± 0.003°
• Cell volume: 1695.7 ± 0.19 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 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: 0.0593
• Residual factor for significantly intense reflections: 0.0433
• Weighted residual factors for significantly intense reflections: 0.1206
• Weighted residual factors for all reflections included in the refinement: 0.136
• Goodness-of-fit parameter for all reflections included in the refinement: 0.592
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No