Information card for entry 1571258

Structure parameters

• Formula: C53 H48 Bi N3 O3 P2 W
• Calculated formula: C46 H40 Bi N3 O3 P2 W
• Title of publication: Combining geometric constraint and redox non-innocence within an ambiphilic PBiP pincer ligand.
• Authors of publication: Coburger, Peter; Buzanich, Ana Guilherme; Emmerling, Franziska; Abbenseth, Josh
• Journal of publication: Chemical science
• Year of publication: 2024
• Journal volume: 15
• Journal issue: 16
• Pages of publication: 6036 - 6043
• a: 10.9439 ± 0.0007 Å
• b: 21.0052 ± 0.001 Å
• c: 21.9721 ± 0.0012 Å
• α: 92.01 ± 0.002°
• β: 101.049 ± 0.002°
• γ: 103.267 ± 0.002°
• Cell volume: 4808.4 ± 0.5 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0908
• Residual factor for significantly intense reflections: 0.0514
• Weighted residual factors for significantly intense reflections: 0.1137
• Weighted residual factors for all reflections included in the refinement: 0.1332
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9746
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No