Information card for entry 7008687

Structure parameters

• Formula: C44 H72 Ag2 B2 Cl4 N12 S6
• Calculated formula: C44 H68 Ag2 B2 Cl4 N12 S6
• Title of publication: Tris(mercaptoimidazolyl)borate complexes of the coinage metals: syntheses and molecular structures of the first gold compounds and related copper and silver derivatives.
• Authors of publication: Patel, Denish V.; Mihalcik, David J.; Kreisel, Kevin A.; Yap, Glenn P. A.; Zakharov, Lev N.; Kassel, W. Scott; Rheingold, Arnold L.; Rabinovich, Daniel
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2005
• Journal issue: 14
• Pages of publication: 2410 - 2416
• a: 11.1232 ± 0.0006 Å
• b: 11.1843 ± 0.0006 Å
• c: 13.7964 ± 0.0008 Å
• α: 95.443 ± 0.001°
• β: 112.811 ± 0.001°
• γ: 106.636 ± 0.001°
• Cell volume: 1474.14 ± 0.14 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0383
• Residual factor for significantly intense reflections: 0.0331
• Weighted residual factors for significantly intense reflections: 0.0785
• Weighted residual factors for all reflections included in the refinement: 0.0808
• Goodness-of-fit parameter for all reflections included in the refinement: 1.095
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No