Information card for entry 7032568

Structure parameters

• Chemical name: bis(bis((1-Methylimidazol-2-yl)methyl)((2-pyridyl)methyl)amine-N,N',N'',N''')-mercury(ii) diperchlorate
• Formula: C39 H48 Cl2 Hg N12 O8
• Calculated formula: C39 H48 Cl2 Hg N12 O8
• Title of publication: Bis-tetradentate complexes of Cd(ii) and Hg(ii) with N8 coordination: structural and NMR comparisons.
• Authors of publication: Bowers, Edith V.; Murphy, Geoffrey S.; Till, Stephanie N.; VandenBussche, Christopher J.; Yaroschak, Melissa M.; Pike, Robert D.; Butcher, Raymond J.; Bebout, Deborah C.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 43
• Pages of publication: 16475 - 16485
• a: 8.9004 ± 0.0016 Å
• b: 11.778 ± 0.002 Å
• c: 11.9676 ± 0.0017 Å
• α: 63.234 ± 0.011°
• β: 82.953 ± 0.013°
• γ: 85.246 ± 0.019°
• Cell volume: 1111.1 ± 0.3 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: 0.037
• Residual factor for significantly intense reflections: 0.0335
• Weighted residual factors for significantly intense reflections: 0.0839
• Weighted residual factors for all reflections included in the refinement: 0.0864
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No