Information card for entry 2225897

Structure parameters

• Chemical name: Dichlorido[<i>N</i>-(2-pyridylmethylidene)benzene-1,4-diamine]zinc(II)
• Formula: C12 H11 Cl2 N3 Zn
• Calculated formula: C12 H11 Cl2 N3 Zn
• SMILES: [Zn]1(Cl)(Cl)[n]2ccccc2C=[N]1c1ccc(cc1)N
• Title of publication: Dichlorido[<i>N</i>-(2-pyridylmethylidene)benzene-1,4-diamine]zinc(II)
• Authors of publication: Shi, Yun-Fen; Feng, Qiao-Hua; Zhao, Wen-Jie; Shi, Yun-Bo; Zhan, Peng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 5
• Pages of publication: m593
• a: 7.5004 ± 0.0015 Å
• b: 9.1168 ± 0.0018 Å
• c: 10.186 ± 0.002 Å
• α: 84.36 ± 0.03°
• β: 82.27 ± 0.03°
• γ: 74.19 ± 0.03°
• Cell volume: 662.7 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0549
• Residual factor for significantly intense reflections: 0.038
• Weighted residual factors for significantly intense reflections: 0.0904
• Weighted residual factors for all reflections included in the refinement: 0.1082
• Goodness-of-fit parameter for all reflections included in the refinement: 0.928
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes