Information card for entry 4350106

Structure parameters

• Chemical name: bis[2,2'-(tris(2-pyridyl)phosphine)]-dithiocyanato-di-silver(I) chloroform solvate
• Formula: C48 H37 Ag2 Cl3 N11 P3 S2
• Calculated formula: C48 H37 Ag2 Cl3 N11 P3 S2
• Title of publication: Sky-blue thermally activated delayed fluorescence (TADF) based on Ag(i) complexes: strong solvation-induced emission enhancement
• Authors of publication: Artem'ev, Alexander V.; Shafikov, Marsel Z.; Schinabeck, Alexander; Antonova, Olga V.; Berezin, Alexey S.; Bagryanskaya, Irina Yu.; Plusnin, Pavel E.; Yersin, Hartmut
• Journal of publication: Inorganic Chemistry Frontiers
• Year of publication: 2019
• Journal volume: 6
• Journal issue: 11
• Pages of publication: 3168
• a: 13.3901 ± 0.0004 Å
• b: 16.8437 ± 0.0004 Å
• c: 22.893 ± 0.0007 Å
• α: 90°
• β: 90.552 ± 0.001°
• γ: 90°
• Cell volume: 5163 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 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: 0.0745
• Residual factor for significantly intense reflections: 0.0472
• Weighted residual factors for significantly intense reflections: 0.119
• Weighted residual factors for all reflections included in the refinement: 0.1402
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No