Information card for entry 4003568

Structure parameters

• Formula: C22 H10 N4 S
• Calculated formula: C22 H10 N4 S
• Title of publication: A General Synthetic Strategy to a Library of Luminescent All-Organic Core‒Shell Microstructures
• Authors of publication: Liu, Kun; Lei, Yilong; Fu, Hongbing
• Journal of publication: Chemistry of Materials
• Year of publication: 2020
• a: 7.158 ± 0.0014 Å
• b: 7.8056 ± 0.0016 Å
• c: 7.9356 ± 0.0016 Å
• α: 72.93 ± 0.03°
• β: 85.74 ± 0.03°
• γ: 88.93 ± 0.03°
• Cell volume: 422.68 ± 0.16 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 4
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0782
• Residual factor for significantly intense reflections: 0.0702
• Weighted residual factors for significantly intense reflections: 0.2147
• Weighted residual factors for all reflections included in the refinement: 0.2212
• Goodness-of-fit parameter for all reflections included in the refinement: 1.062
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No