Information card for entry 7062059

Structure parameters

• Common name: MD22
• Formula: C21 H16 Ag F3 N2 O3 S3 Se
• Calculated formula: C21 H16 Ag F3 N2 O3 S3 Se
• Title of publication: On the coordination behaviour of diorganoselenium ligands based on amino and azole functionalities: silver(i) complexes with relevance for biological applications
• Authors of publication: Popa, Roxana A.; David, Maria; Licarete, Emilia; Banciu, Manuela; Silvestru, Anca
• Journal of publication: New Journal of Chemistry
• Year of publication: 2022
• Journal volume: 46
• Journal issue: 48
• Pages of publication: 23019 - 23029
• a: 10.2327 ± 0.0004 Å
• b: 10.6375 ± 0.0003 Å
• c: 12.0832 ± 0.0004 Å
• α: 113.099 ± 0.001°
• β: 97.051 ± 0.001°
• γ: 97.796 ± 0.001°
• Cell volume: 1176.07 ± 0.07 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0249
• Residual factor for significantly intense reflections: 0.0217
• Weighted residual factors for significantly intense reflections: 0.05
• Weighted residual factors for all reflections included in the refinement: 0.0517
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No