Information card for entry 1549573

Structure parameters

• Formula: C39 H42 F9 N10 O9 P S3
• Calculated formula: C39 H42 F9 N10 O9 P S3
• SMILES: P12[n]3c4ccccc4n(c3CN(Cc3[n]2c2c(n3CC)cccc2)Cc2[n]1c1c(n2CC)cccc1)CC.S(=O)(=O)([O-])C(F)(F)F.S(=O)(=O)([O-])C(F)(F)F.S(=O)(=O)([O-])C(F)(F)F.N#CC.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: 10.8599 ± 0.0007 Å
• b: 10.9646 ± 0.0008 Å
• c: 20.3805 ± 0.0014 Å
• α: 81.217 ± 0.002°
• β: 83.234 ± 0.002°
• γ: 89.295 ± 0.002°
• Cell volume: 2381.6 ± 0.3 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 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: 0.094
• Residual factor for significantly intense reflections: 0.0539
• Weighted residual factors for significantly intense reflections: 0.1264
• Weighted residual factors for all reflections included in the refinement: 0.148
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0695
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No