Information card for entry 1559863

Structure parameters

• Formula: C32 H30 N2 S4 Si2
• Calculated formula: C32 H30 N2 S4 Si2
• SMILES: c12c(c3c(c4c(c5c1sc(c5)c1cnccc1)cc(s4)[Si](C)(C)C)sc(c3)c1cnccc1)cc(s2)[Si](C)(C)C
• Title of publication: Ag-Induced metallogel based on cyclooctatetrathiophene: structural characterization and stimuli-responsive properties.
• Authors of publication: Tian, Yu; Wang, Chenglong; Wang, Guangxia; Xu, Li; Wang, Hua
• Journal of publication: Soft matter
• Year of publication: 2021
• Journal volume: 17
• Journal issue: 2
• Pages of publication: 341 - 345
• a: 10.1836 ± 0.0008 Å
• b: 16.2598 ± 0.0012 Å
• c: 23.1451 ± 0.0014 Å
• α: 86.414 ± 0.005°
• β: 81.109 ± 0.006°
• γ: 77.472 ± 0.006°
• Cell volume: 3694.6 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1241
• Residual factor for significantly intense reflections: 0.0805
• Weighted residual factors for significantly intense reflections: 0.1835
• Weighted residual factors for all reflections included in the refinement: 0.2044
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No