Information card for entry 7207000

Structure parameters

• Formula: C12 H16 Cl2 N4 Zn
• Calculated formula: C12 H16 Cl2 N4 Zn
• Title of publication: Zinc, cobalt and copper coordination polymers with different structural motifs from picolyl-triazole hybrid ligands
• Authors of publication: Bai, Shi-Qiang; Yong, Anna Marie; Hu, Jian Jin; Young, David J.; Zhang, Xinhai; Zong, Yun; Xu, Jianwei; Zuo, Jing-Lin; Hor, T. S. Andy
• Journal of publication: CrystEngComm
• Year of publication: 2012
• Journal volume: 14
• Journal issue: 3
• Pages of publication: 961
• a: 12.4667 ± 0.0006 Å
• b: 9.3666 ± 0.0005 Å
• c: 14.1959 ± 0.0007 Å
• α: 90°
• β: 112.62 ± 0.001°
• γ: 90°
• Cell volume: 1530.15 ± 0.13 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0258
• Residual factor for significantly intense reflections: 0.0241
• Weighted residual factors for significantly intense reflections: 0.0638
• Weighted residual factors for all reflections included in the refinement: 0.0646
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No