Information card for entry 7717787

Structure parameters

• Formula: C29 H30 Ag F3 N10 O3 S
• Calculated formula: C29 H30 Ag F3 N10 O3 S
• Title of publication: Identification of novel triazolylquinoxaline-based metal complexes supported by experimental and virtual screenings.
• Authors of publication: Holzhauer, Laura; Shekhovtsev, Vitalii; Bruschi, Cecilia; Gunther, Mathis; Fuhr, Olaf; Hodapp, Patrick; Bizzarri, Claudia; Wenzel, Wolfgang; Jung, Nicole; Bräse, Stefan
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 8
• Pages of publication: 3287 - 3295
• a: 14.1441 ± 0.0004 Å
• b: 15.5702 ± 0.0004 Å
• c: 15.1099 ± 0.0004 Å
• α: 90°
• β: 111.231 ± 0.002°
• γ: 90°
• Cell volume: 3101.75 ± 0.15 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 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: 0.0302
• Residual factor for significantly intense reflections: 0.0285
• Weighted residual factors for significantly intense reflections: 0.0735
• Weighted residual factors for all reflections included in the refinement: 0.0745
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.34143 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No