Information card for entry 7219962

Structure parameters

• Formula: C11 H14 Cl2 N4 Zn
• Calculated formula: C11 H14 Cl2 N4 Zn
• Title of publication: Five Cu(i) and Zn(ii) clusters and coordination polymers of 2-pyridyl-1,2,3-triazoles: synthesis, structures and luminescence properties
• Authors of publication: Bai, Shi-Qiang; Jiang, Lu; Sun, Bin; Young, David James; Hor, T. S. Andy
• Journal of publication: CrystEngComm
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 17
• Pages of publication: 3305
• a: 7.1708 ± 0.0004 Å
• b: 8.4435 ± 0.0004 Å
• c: 12.2732 ± 0.0006 Å
• α: 91.226 ± 0.0011°
• β: 101.4 ± 0.0012°
• γ: 111.39 ± 0.001°
• Cell volume: 674.7 ± 0.06 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0186
• Residual factor for significantly intense reflections: 0.0181
• Weighted residual factors for significantly intense reflections: 0.0442
• Weighted residual factors for all reflections included in the refinement: 0.0444
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No