Information card for entry 7041566

Structure parameters

• Formula: C13 H12 Cl2 N2 Zn
• Calculated formula: C13 H12 Cl2 N2 Zn
• SMILES: c1cccc2C=[N](c3ccc(cc3)C)[Zn](Cl)(Cl)[n]12
• Title of publication: Different conjugated system Zn(ii) Schiff base complexes: supramolecular structure, luminescent properties, and applications in the PMMA-doped hybrid materials.
• Authors of publication: Dong, Yu-Wei; Fan, Rui-Qing; Chen, Wei; Zhang, Hui-Jie; Song, Yang; Du, Xi; Wang, Ping; Wei, Li-Guo; Yang, Yu-Lin
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 4
• Pages of publication: 1266 - 1276
• a: 11.952 ± 0.007 Å
• b: 9.847 ± 0.008 Å
• c: 14.876 ± 0.006 Å
• α: 90°
• β: 127.535 ± 0.019°
• γ: 90°
• Cell volume: 1388.3 ± 1.5 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1134
• Residual factor for significantly intense reflections: 0.0635
• Weighted residual factors for significantly intense reflections: 0.1528
• Weighted residual factors for all reflections included in the refinement: 0.1771
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No