Information card for entry 7202835

Structure parameters

• Formula: C12 H10 Br2 Hg N4
• Calculated formula: C12 H10 Br2 Hg N4
• Title of publication: Mercury(ii) coordination polymers generated from 1,4-bis(2 or 3 or 4-pyridyl)-2,3-diaza-1,3-butadiene ligands
• Authors of publication: Mahmoudi, Ghodrat; Morsali, Ali; Hunter, Allen D.; Zeller, Matthias
• Journal of publication: CrystEngComm
• Year of publication: 2007
• Journal volume: 9
• Journal issue: 8
• Pages of publication: 704
• a: 4.9173 ± 0.0004 Å
• b: 23.3133 ± 0.0017 Å
• c: 12.9459 ± 0.0009 Å
• α: 90°
• β: 93.332 ± 0.001°
• γ: 90°
• Cell volume: 1481.59 ± 0.19 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: 0.0295
• Residual factor for significantly intense reflections: 0.0241
• Weighted residual factors for significantly intense reflections: 0.0532
• Weighted residual factors for all reflections included in the refinement: 0.0548
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No