Information card for entry 7047065

Structure parameters

• Formula: C22 H22 B N4 Rh
• Calculated formula: C22 H22 B N4 Rh
• Title of publication: Preparation and Reactivity of Rhodium and Iridium Complexes Containing a Methylborohydride Based Unit Supported by Two 7-Azaindolyl Heterocycles
• Authors of publication: Da Costa, Rosenildo Correa; Rawe, Benjamin W.; Tsoureas, Nikolaos; Haddow, Mairi F.; Sparkes, Hazel Anne; Tizzard, Graham J.; Coles, Simon; Owen, Gareth Richard
• Journal of publication: Dalton Transactions
• Year of publication: 2018
• a: 22.5002 ± 0.0003 Å
• b: 10.5702 ± 0.0002 Å
• c: 15.9172 ± 0.0002 Å
• α: 90°
• β: 93.748 ± 0.001°
• γ: 90°
• Cell volume: 3777.52 ± 0.1 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0223
• Residual factor for significantly intense reflections: 0.0207
• Weighted residual factors for significantly intense reflections: 0.0531
• Weighted residual factors for all reflections included in the refinement: 0.0544
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No