Information card for entry 4327680

Structure parameters

• Formula: C27.5 H30 Cl2 Hg N6 O8
• Calculated formula: C27.5 H29.5 Cl2 Hg N6 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: 10.953 ± 0.005 Å
• b: 12.812 ± 0.005 Å
• c: 13.006 ± 0.005 Å
• α: 67.5 ± 0.03°
• β: 82.74 ± 0.03°
• γ: 67.88 ± 0.03°
• Cell volume: 1561.8 ± 1.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0452
• Residual factor for significantly intense reflections: 0.039
• Weighted residual factors for all reflections: 0.1019
• Weighted residual factors for significantly intense reflections: 0.0996
• Goodness-of-fit parameter for all reflections: 0.983
• Goodness-of-fit parameter for significantly intense reflections: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No