Information card for entry 4127668

Structure parameters

• Formula: C19 H18 N2 O5 S2
• Calculated formula: C19 H18 N2 O5 S2
• Title of publication: Dynamic Covalent Switches and Communicating Networks for Tunable Multicolor Luminescent Systems and Vapor-Responsive Materials.
• Authors of publication: Zou, Hanxun; Hai, Yu; Ye, Hebo; You, Lei
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2019
• Journal volume: 141
• Journal issue: 41
• Pages of publication: 16344 - 16353
• a: 7.4153 ± 0.0005 Å
• b: 9.9309 ± 0.0006 Å
• c: 12.3718 ± 0.0007 Å
• α: 92.686 ± 0.005°
• β: 96.211 ± 0.005°
• γ: 90.945 ± 0.005°
• Cell volume: 904.51 ± 0.1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0463
• Residual factor for significantly intense reflections: 0.0393
• Weighted residual factors for significantly intense reflections: 0.0929
• Weighted residual factors for all reflections included in the refinement: 0.0972
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No