Information card for entry 4327681

Structure parameters

• Formula: C14 H16 Cl2 Hg N4 O8
• Calculated formula: C14 H13 Cl2 Hg N4 O8
• Title of publication: Characterization of Mercury(II) Complexes of Bis[(2-pyridyl)methyl]amine by X-ray Crystallography and NMR Spectroscopy
• Authors of publication: Deborah C. Bebout; Anne E. DeLanoy; David E. Ehmann; Margaret E. Kastner; Damon A. Parrish; Raymond J. Butcher
• Journal of publication: Inorganic Chemistry
• Year of publication: 1998
• Journal volume: 37
• Pages of publication: 2952 - 2959
• a: 12.987 ± 0.002 Å
• b: 17.469 ± 0.004 Å
• c: 8.886 ± 0.002 Å
• α: 90°
• β: 95.2 ± 0.012°
• γ: 90°
• Cell volume: 2007.7 ± 0.7 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/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0972
• Residual factor for significantly intense reflections: 0.0574
• Weighted residual factors for all reflections: 0.1566
• Weighted residual factors for significantly intense reflections: 0.1305
• Goodness-of-fit parameter for all reflections: 1.016
• Goodness-of-fit parameter for significantly intense reflections: 1.077
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No