Information card for entry 7708912

Structure parameters

• Formula: C226.5 H459 Ag58 N46.4 O94.2 S30
• Calculated formula: C226.5 H459 Ag58 N46.4 O94.2 S30
• Title of publication: Self-assembly patterns of non-metalloid silver thiolates: structural, HR-ESI-MS and stability studies
• Authors of publication: Chupina, Anastasia; Abramov, Pavel A.; Yanshole, Vadim V.; Sulyaeva, Veronica S.; Kokovkin, Vasily; Sokolov, Maksim Nailyevich
• Journal of publication: Dalton Transactions
• Year of publication: 2021
• a: 15.9769 ± 0.0004 Å
• b: 25.0801 ± 0.0004 Å
• c: 25.4499 ± 0.0004 Å
• α: 100.571 ± 0.001°
• β: 101.461 ± 0.002°
• γ: 102.566 ± 0.002°
• Cell volume: 9477.2 ± 0.3 ų
• Cell temperature: 140 ± 2 K
• Ambient diffraction temperature: 140 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1686
• Residual factor for significantly intense reflections: 0.0752
• Weighted residual factors for significantly intense reflections: 0.1654
• Weighted residual factors for all reflections included in the refinement: 0.2013
• Goodness-of-fit parameter for all reflections included in the refinement: 0.998
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No