Information card for entry 7062165

Structure parameters

• Common name: INA4
• Formula: C20 H19 N O2 S
• Calculated formula: C20 H19 N O2 S
• Title of publication: Silver(i) complexes containing heteroleptic diorganochalcogen(ii) ligands
• Authors of publication: Butuza, Roxana A.; Dumitraş, Darius; Bohan, Cosmina; Pop, Alexandra
• Journal of publication: New Journal of Chemistry
• Year of publication: 2023
• Journal volume: 47
• Journal issue: 5
• Pages of publication: 2202 - 2210
• a: 18.681 ± 0.002 Å
• b: 5.2749 ± 0.0006 Å
• c: 17.908 ± 0.002 Å
• α: 90°
• β: 104.319 ± 0.004°
• γ: 90°
• Cell volume: 1709.8 ± 0.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• 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: 0.2132
• Residual factor for significantly intense reflections: 0.0999
• Weighted residual factors for significantly intense reflections: 0.1527
• Weighted residual factors for all reflections included in the refinement: 0.19
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No