Information card for entry 1549569

Structure parameters

• Chemical name: tris((1-ethyl-1H-benzo[d]imidazol-2-yl)methyl)amino arsenic tristriflate
• Formula: C37 H39 As F9 N9 O9 S3
• Calculated formula: C37 H39 As F9 N9 O9 S3
• SMILES: [As]123([N](Cc4n(c5ccccc5[n]14)CC)(Cc1n(c4ccccc4[n]21)CC)Cc1n(c2ccccc2[n]31)CC)(OS(=O)(=O)C(F)(F)F)OS(=O)(=O)C(F)(F)F.S(=O)(=O)([O-])C(F)(F)F.N#CC.N#CC
• Title of publication: Tris(benzoimidazol)amine (L) complexes of pnictogen(iii) and pnictogen(v) cations and assessment of the [LP]³⁺/[LPF₂]³⁺ redox couple.
• Authors of publication: Swidan, Ala'aeddeen; Suter, Riccardo; Macdonald, Charles L. B.; Burford, Neil
• Journal of publication: Chemical science
• Year of publication: 2018
• Journal volume: 9
• Journal issue: 26
• Pages of publication: 5837 - 5841
• a: 14.0065 ± 0.0003 Å
• b: 15.9167 ± 0.0003 Å
• c: 21.8331 ± 0.0005 Å
• α: 90°
• β: 107.966 ± 0.0013°
• γ: 90°
• Cell volume: 4630.08 ± 0.17 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173.15 K
• Number of distinct elements: 7
• 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: 0.0989
• Residual factor for significantly intense reflections: 0.0898
• Weighted residual factors for significantly intense reflections: 0.2548
• Weighted residual factors for all reflections included in the refinement: 0.2635
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No