Information card for entry 7064447

Structure parameters

• Formula: C60 H90 Ag2 F6 O6 P2 S2
• Calculated formula: C60 H90 Ag2 F6 O6 P2 S2
• Title of publication: A highly intensive red luminescent benzotriazolate complex of {Mo6I8} with {Ag(tBuXPhos)}
• Authors of publication: Gorbachuk, Elena; Mikhaylov, Maxim; Tagiltsev, Kirill; Yudin, Vasily; Sukhikh, Taisiya; Sukhov, Aleksandr; Faizullin, Bulat; Shmelev, Artemiy; Nikiforov, Viktor; Sokolov, Maxim; Yakhvarov, Dmitry
• Journal of publication: New Journal of Chemistry
• Year of publication: 2026
• a: 10.9171 ± 0.0002 Å
• b: 20.4854 ± 0.0003 Å
• c: 14.6193 ± 0.0003 Å
• α: 90°
• β: 103.637 ± 0.0005°
• γ: 90°
• Cell volume: 3177.3 ± 0.1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0461
• Residual factor for significantly intense reflections: 0.0348
• Weighted residual factors for significantly intense reflections: 0.0707
• Weighted residual factors for all reflections included in the refinement: 0.0776
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No