Information card for entry 7043842

Structure parameters

• Formula: C108 H153 Ag3 O9 S3 Si3
• Calculated formula: C108 H153 Ag3 O9 S3 Si3
• SMILES: c1(c(cccc1C(C)C)C(C)C)O[Si](Oc1c(cccc1C(C)C)C(C)C)(Oc1c(cccc1C(C)C)C(C)C)[S]1[Ag][S]([Si](Oc2c(cccc2C(C)C)C(C)C)(Oc2c(cccc2C(C)C)C(C)C)Oc2c(cccc2C(C)C)C(C)C)[Ag][S]([Si](Oc2c(cccc2C(C)C)C(C)C)(Oc2c(cccc2C(C)C)C(C)C)Oc2c(cccc2C(C)C)C(C)C)[Ag]1
• Title of publication: Silver complexes stabilized by large silanethiolate ligands ‒ crystal structures and luminescence properties
• Authors of publication: Ciborska, Anna; Hnatejko, Zbigniew; Kazimierczuk, Katarzyna; Mielcarek, Agnieszka; Wiśniewska, Aleksandra; Dołęga, Anna
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 17.8298 ± 0.0004 Å
• b: 19.7016 ± 0.0005 Å
• c: 19.9173 ± 0.0005 Å
• α: 118.104 ± 0.003°
• β: 106.97 ± 0.002°
• γ: 97.025 ± 0.002°
• Cell volume: 5616 ± 0.3 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 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: 0.0539
• Residual factor for significantly intense reflections: 0.0432
• Weighted residual factors for significantly intense reflections: 0.1056
• Weighted residual factors for all reflections included in the refinement: 0.1146
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No