Information card for entry 7126741

Structure parameters

• Formula: C21 H28 Ag F6 N4 P
• Calculated formula: C21 H28 Ag F6 N4 P
• Title of publication: Asymmetric [N-I-N]⁺ halonium complexes.
• Authors of publication: Ward, Jas S.; Fiorini, Giorgia; Frontera, Antonio; Rissanen, Kari
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2020
• Journal volume: 56
• Journal issue: 60
• Pages of publication: 8428 - 8431
• a: 10.4171 ± 0.0006 Å
• b: 10.7634 ± 0.0005 Å
• c: 11.4213 ± 0.0007 Å
• α: 100.44 ± 0.004°
• β: 108.085 ± 0.005°
• γ: 94.085 ± 0.004°
• Cell volume: 1185.99 ± 0.12 ų
• Cell temperature: 120 ± 0.13 K
• Ambient diffraction temperature: 120 ± 0.13 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: 0.0612
• Residual factor for significantly intense reflections: 0.0431
• Weighted residual factors for significantly intense reflections: 0.0899
• Weighted residual factors for all reflections included in the refinement: 0.0996
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No