Information card for entry 4317575

Structure parameters

• Formula: C38 H32 Br2 Cl4 Hg2 P2
• Calculated formula: C38 H32 Br2 Cl4 Hg2 P2
• SMILES: [Hg](Br)(Br)([P](c1c([Hg]2)cccc1)(c1ccccc1)c1ccccc1)[P](c1c2cccc1)(c1ccccc1)c1ccccc1.ClCCl.ClCCl
• Title of publication: Bis{(2-diphenylphosphino)phenyl}mercury: A P-Donor Ligand and Precursor to Mixed Metal-Mercury (d8-d10) Cyclometalated Complexes Containing 2-C6H4PPh2
• Authors of publication: Martin A. Bennett; Maria Contel; David C. R. Hockless; Lee L. Welling; Anthony C. Willis
• Journal of publication: Inorganic Chemistry
• Year of publication: 2002
• Journal volume: 41
• Pages of publication: 844 - 855
• a: 12.72 ± 0.003 Å
• b: 13.154 ± 0.002 Å
• c: 12.724 ± 0.002 Å
• α: 92.01 ± 0.02°
• β: 109.19 ± 0.02°
• γ: 90.82 ± 0.02°
• Cell volume: 2008.7 ± 0.7 ų
• Cell temperature: 193.2 K
• Ambient diffraction temperature: 193.2 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: 0.0536
• Residual factor for significantly intense reflections: 0.0472
• Weighted residual factors for all reflections: 0.0565
• Weighted residual factors for all reflections included in the refinement: 0.0557
• Goodness-of-fit parameter for all reflections: 2.644
• Goodness-of-fit parameter for all reflections included in the refinement: 2.802
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No