Information card for entry 7048240

Structure parameters

• Formula: C16 H24 B N6 O P Ru S3
• Calculated formula: C15.997 H23.991 B N6 O P0.999 Ru S3
• Title of publication: Synthesis and ligand substitution reactions of κ⁴-B,S,S',S''-ruthenaboratranes.
• Authors of publication: Foreman, Mark R St-J; Hill, Anthony F.; Ma, Chenxi; Tshabang, Never; White, Andrew J. P.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 48
• Journal issue: 1
• Pages of publication: 209 - 219
• a: 13.763 ± 0.002 Å
• b: 12.5156 ± 0.0018 Å
• c: 13.792 ± 0.003 Å
• α: 90°
• β: 95.727 ± 0.014°
• γ: 90°
• Cell volume: 2363.8 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• 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: 0.0614
• Residual factor for significantly intense reflections: 0.039
• Weighted residual factors for significantly intense reflections: 0.0784
• Weighted residual factors for all reflections included in the refinement: 0.0871
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No