Information card for entry 7024971

Structure parameters

• Formula: C31 H45 B N7 O2 Rh S2
• Calculated formula: C31 H37 B N7 O2 Rh S2
• Title of publication: Heterolytic H2 activation by rhodium thiolato complexes bearing the hydrotris(pyrazolyl)borato ligand and application to catalytic hydrogenation under mild conditions.
• Authors of publication: Seino, Hidetake; Misumi, Yoshiyuki; Hojo, Yoshihiro; Mizobe, Yasushi
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 12
• Pages of publication: 3072 - 3082
• a: 10.1804 ± 0.0015 Å
• b: 22.607 ± 0.004 Å
• c: 14.737 ± 0.002 Å
• α: 90°
• β: 91.287 ± 0.0007°
• γ: 90°
• Cell volume: 3390.8 ± 0.9 ų
• Cell temperature: 113.1 K
• Ambient diffraction temperature: 113.1 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 significantly intense reflections: 0.0465
• Weighted residual factors for all reflections included in the refinement: 0.1228
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No