Information card for entry 7203971

Structure parameters

• Formula: C24 H30 N2 O5 S
• Calculated formula: C24 H30 N2 O5 S
• SMILES: S(=O)(=O)([O-])c1ccc(cc1)C.N(c1ccc(cc1)/C=C/c1cc[n+](cc1)C)(CCO)C.O
• Title of publication: Synthesis, structures and two-photon pumped up-conversion lasing properties of two new organic salts
• Authors of publication: Ren, Yan; Fang, Qi; Yu, Wen-Tao; Lei, Hong; Tian, Yu-Peng; Jiang, Min-Hua; Yang, Qing-Chuan; Mak, Thomas C. W.
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2000
• Journal volume: 10
• Journal issue: 9
• Pages of publication: 2025
• a: 9.929 ± 0.002 Å
• b: 19.549 ± 0.004 Å
• c: 12.1 ± 0.002 Å
• α: 90°
• β: 96.11 ± 0.03°
• γ: 90°
• Cell volume: 2335.3 ± 0.8 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 5
• 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: 0.0811
• Residual factor for significantly intense reflections: 0.0776
• Weighted residual factors for significantly intense reflections: 0.2303
• Weighted residual factors for all reflections included in the refinement: 0.2347
• Goodness-of-fit parameter for all reflections included in the refinement: 1.091
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No