Information card for entry 7219762

Structure parameters

• Formula: C26 H22 Cl2 N4 O2 Zn2
• Calculated formula: C26 H22 Cl2 N4 O2 Zn2
• SMILES: c1[n]2[Zn]34(Cl)[N](Cc2ccc1)=Cc1ccccc1[O]3[Zn]12([n]3ccccc3C[N]1=Cc1ccccc1[O]42)Cl
• Title of publication: Two Schiff base ligands for distiguishing ZnII/CdIIsensing — effect of substituent on fluorecent sensing
• Authors of publication: Zheng, Zhi-Peng; Wei, Qin; Yin, Wen-Xia; Wan, Lin-Tao; Huang, Xia; Yu, Ying; Cai, Prof. Yue-Peng
• Journal of publication: RSC Adv.
• Year of publication: 2015
• a: 9.33 ± 0.003 Å
• b: 9.003 ± 0.003 Å
• c: 15.332 ± 0.004 Å
• α: 90°
• β: 103.388 ± 0.004°
• γ: 90°
• Cell volume: 1252.9 ± 0.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 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: 0.0371
• Residual factor for significantly intense reflections: 0.0276
• Weighted residual factors for significantly intense reflections: 0.0684
• Weighted residual factors for all reflections included in the refinement: 0.0721
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No