Information card for entry 4086876

Structure parameters

• Chemical name: n6-triphenylmethane-1,5-cyclooctadieneiridium(I) tetrakis(3,5-trifluoromethylphenyl)borate
• Formula: C47.96 H35 B F24 Ir N
• Calculated formula: C48 H35 B F24 Ir N
• Title of publication: Accessing δ-B‒H Coordinated Complexes of Rh(I) and Ir(I) Using Mono- and Dihydroboranes: Cooperative Stabilization by a Phosphoramidate Coligand
• Authors of publication: Drover, Marcus W.; Bowes, Eric G.; Love, Jennifer A.; Schafer, Laurel L.
• Journal of publication: Organometallics
• Year of publication: 2016
• a: 13.039 ± 0.002 Å
• b: 13.042 ± 0.002 Å
• c: 17.176 ± 0.003 Å
• α: 100.771 ± 0.004°
• β: 101.143 ± 0.004°
• γ: 119.129 ± 0.003°
• Cell volume: 2365 ± 0.7 ų
• Cell temperature: 90 K
• Ambient diffraction temperature: 90 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.044
• Residual factor for significantly intense reflections: 0.038
• Weighted residual factors for significantly intense reflections: 0.096
• Weighted residual factors for all reflections included in the refinement: 0.1005
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No