Information card for entry 2020521

Structure parameters

• Chemical name: Carbonyl(cyanotrihydridoborato-κ<i>N</i>)bis(triphenylphosphine-κ<i>P</i>)rhodium(I)
• Formula: C38 H33 B N O P2 Rh
• Calculated formula: C38 H33 B N O P2 Rh
• Title of publication: Diminished electron density in the Vaska-type rhodium(I) complex <i>trans</i>-[Rh(NCBH~3~)(CO)(PPh~3~)~2~]
• Authors of publication: Galding, M. R.; Virovets, A. V.; Kazakov, I. V.; Scheer, M.; Smirnov, S. N.; Timoshkin, A. Y.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2016
• Journal volume: 72
• Journal issue: 7
• Pages of publication: 514 - 517
• a: 13.9227 ± 0.0001 Å
• b: 12.35 ± 0.0001 Å
• c: 19.7966 ± 0.0001 Å
• α: 90°
• β: 105.987 ± 0.001°
• γ: 90°
• Cell volume: 3272.28 ± 0.04 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 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: 0.0222
• Residual factor for significantly intense reflections: 0.0207
• Weighted residual factors for significantly intense reflections: 0.0553
• Weighted residual factors for all reflections included in the refinement: 0.0559
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes