Information card for entry 7128735

Structure parameters

• Formula: C47 H56 B N7 P Sc
• Calculated formula: C47 H56 B N7 P Sc
• Title of publication: A monoanionic pentadentate ligand platform for scandium-pnictogen multiple bonds.
• Authors of publication: Patrick, Evan A.; Yang, Yan; Piers, Warren E.; Maron, Laurent; Gelfand, Benjamin S.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2021
• Journal volume: 57
• Journal issue: 69
• Pages of publication: 8640 - 8643
• a: 8.397 ± 0.0018 Å
• b: 10.808 ± 0.002 Å
• c: 24.445 ± 0.005 Å
• α: 93.476 ± 0.006°
• β: 95.859 ± 0.007°
• γ: 91.758 ± 0.006°
• Cell volume: 2201.3 ± 0.8 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 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: 0.0375
• Residual factor for significantly intense reflections: 0.0359
• Weighted residual factors for significantly intense reflections: 0.0949
• Weighted residual factors for all reflections included in the refinement: 0.0962
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No