Information card for entry 4350273

Structure parameters

• Formula: C8 H8 Br2 N2 Zn
• Calculated formula: C8 H8 Br2 N4 Zn
• Title of publication: On the preparation of coordination polymers by controlled thermal decomposition: synthesis, crystal structures, and thermal properties of zinc halide pyrazine coordination compounds.
• Authors of publication: Bhosekar, Gaurav; Jess, Inke; Näther, Christian
• Journal of publication: Inorganic chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 16
• Pages of publication: 6508 - 6515
• a: 7.1969 ± 0.0008 Å
• b: 7.1969 ± 0.0008 Å
• c: 11.1356 ± 0.0015 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 576.77 ± 0.12 ų
• Cell temperature: 170 ± 2 K
• Ambient diffraction temperature: 170 ± 2 K
• Number of distinct elements: 5
• Space group number: 139
• Hermann-Mauguin space group symbol: I 4/m m m
• Hall space group symbol: -I 4 2
• Residual factor for all reflections: 0.0231
• Residual factor for significantly intense reflections: 0.0228
• Weighted residual factors for significantly intense reflections: 0.0552
• Weighted residual factors for all reflections included in the refinement: 0.0554
• Goodness-of-fit parameter for all reflections included in the refinement: 1.188
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No