Information card for entry 7243406

Structure parameters

• Formula: C23 H14 N2 O6 S Zn
• Calculated formula: C23 H14 N2 O6 S Zn
• Title of publication: Construction of a viologen-derived 2D material with photochromism, photoswitchable luminescence and inkless and erasable prints via sunlight irradiation
• Authors of publication: Li, Zhao-Hao; Xue, Li-Ping; Liu, Si-Rui; Wang, Si-Jin
• Journal of publication: CrystEngComm
• Year of publication: 2021
• Journal volume: 23
• Journal issue: 36
• Pages of publication: 6315 - 6321
• a: 10.146 ± 0.002 Å
• b: 13.915 ± 0.002 Å
• c: 14.641 ± 0.012 Å
• α: 90°
• β: 96.29 ± 0.07°
• γ: 90°
• Cell volume: 2054.6 ± 1.8 ų
• Cell temperature: 290.6 ± 0.3 K
• Ambient diffraction temperature: 290.6 ± 0.3 K
• Number of distinct elements: 6
• 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: 0.0469
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for significantly intense reflections: 0.0757
• Weighted residual factors for all reflections included in the refinement: 0.0797
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No