Information card for entry 7228068

Structure parameters

• Formula: C26 H15 N6 O11 Zn2
• Calculated formula: C26 H10 N6 O11 Zn2
• Title of publication: Two (5, 5)-connected isomeric frameworks as highly selective and sensitive photoluminescent probes of nitroaromatics
• Authors of publication: Dai, Yue; Zhou, Huajun; Song, Xuedan; Zhang, Jian-Jun; Hao, Ce; Di, Ling; Wang, Yu-Xian; Ni, Jun; Wang, Hui-Long
• Journal of publication: CrystEngComm
• Year of publication: 2017
• a: 18.8984 ± 0.0018 Å
• b: 17.7031 ± 0.0018 Å
• c: 14.4754 ± 0.0014 Å
• α: 90°
• β: 96.602 ± 0.002°
• γ: 90°
• Cell volume: 4810.8 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 5
• Hermann-Mauguin space group symbol: C 1 2 1
• Hall space group symbol: C 2y
• Residual factor for all reflections: 0.0452
• Residual factor for significantly intense reflections: 0.038
• Weighted residual factors for significantly intense reflections: 0.0927
• Weighted residual factors for all reflections included in the refinement: 0.0954
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No