Information card for entry 7202837

Structure parameters

• Formula: C6 H5 Br2 Hg N2
• Calculated formula: C6 H5 Br2 Hg N2
• 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: 4.0783 ± 0.0008 Å
• b: 9.1943 ± 0.0017 Å
• c: 11.753 ± 0.002 Å
• α: 87.235 ± 0.003°
• β: 88.002 ± 0.003°
• γ: 85.696 ± 0.003°
• Cell volume: 438.73 ± 0.14 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: 0.0428
• Residual factor for significantly intense reflections: 0.0408
• Weighted residual factors for significantly intense reflections: 0.1015
• Weighted residual factors for all reflections included in the refinement: 0.1026
• Goodness-of-fit parameter for all reflections included in the refinement: 1.112
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No