Information card for entry 7250327

Structure parameters

• Formula: C15 H18 Ag F6 N4 O3 P
• Calculated formula: C15 H18 Ag F6 N4 O3 P
• Title of publication: Hierarchical iodine(i) complexes of nicotinamide
• Authors of publication: Mohan, Sharath; Valkonen, Arto; Rissanen, Kari; Ward, Jas S.
• Journal of publication: CrystEngComm
• Year of publication: 2025
• Journal volume: 27
• Journal issue: 20
• Pages of publication: 3295 - 3301
• a: 8.5896 ± 0.0001 Å
• b: 23.3498 ± 0.0002 Å
• c: 9.9286 ± 0.0001 Å
• α: 90°
• β: 98.579 ± 0.001°
• γ: 90°
• Cell volume: 1969.05 ± 0.04 ų
• Cell temperature: 119.95 ± 0.16 K
• Ambient diffraction temperature: 119.95 ± 0.16 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0293
• Residual factor for significantly intense reflections: 0.0277
• Weighted residual factors for significantly intense reflections: 0.073
• Weighted residual factors for all reflections included in the refinement: 0.0741
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No