Information card for entry 4502286

Structure parameters

• Formula: C10 H11 Br Hg N10 O0
• Calculated formula: C10 H11 Br Hg N10
• Title of publication: ZnIIand HgIIComplexes with 2,3-Substituted-5,6-di(1H-tetrazol-5-yl)pyrazine Ligands: Roles of Substituting Groups and Synthetic Conditions on the Formation of Complexes
• Authors of publication: Tao, Ying; Li, Jian-Rong; Chang, Ze; Bu, Xian-He
• Journal of publication: Crystal Growth & Design
• Year of publication: 2010
• Journal volume: 10
• Journal issue: 2
• Pages of publication: 564
• a: 10.064 ± 0.002 Å
• b: 13.053 ± 0.003 Å
• c: 12.178 ± 0.002 Å
• α: 90°
• β: 101.49 ± 0.03°
• γ: 90°
• Cell volume: 1567.7 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.059
• Residual factor for significantly intense reflections: 0.0411
• Weighted residual factors for significantly intense reflections: 0.0727
• Weighted residual factors for all reflections included in the refinement: 0.0785
• Goodness-of-fit parameter for all reflections included in the refinement: 0.963
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No