Information card for entry 4305731

Structure parameters

• Formula: C26 H22 B N2 O4 Rh
• Calculated formula: C26 H22 B N2 O4 Rh
• SMILES: [Rh]123456([n]7c(C=[N]1c1c(cccc1C)C)cccc7)[c]17[cH]2[cH]3[cH]4[cH]5[c]67O[B]2(O1)Oc1ccccc1O2
• Title of publication: Synthesis, Characterization, and Reactivity of Rhodium(I) Acetylacetonato Complexes Containing Pyridinecarboxaldimine Ligands
• Authors of publication: Diane A. Kanas; Stephen J. Geier; Christopher M. Vogels; Andreas Decken; Stephen A. Westcott
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 8727 - 8735
• a: 11.245 ± 0.004 Å
• b: 15.187 ± 0.006 Å
• c: 13.529 ± 0.005 Å
• α: 90°
• β: 94.561 ± 0.006°
• γ: 90°
• Cell volume: 2303.1 ± 1.5 ų
• Cell temperature: 173 ± 1 K
• Ambient diffraction temperature: 173 ± 1 K
• Number of distinct elements: 6
• 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: 0.0692
• Residual factor for significantly intense reflections: 0.0378
• Weighted residual factors for significantly intense reflections: 0.0864
• Weighted residual factors for all reflections included in the refinement: 0.106
• Goodness-of-fit parameter for all reflections included in the refinement: 1.135
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No