Information card for entry 4311134

Structure parameters

• Formula: C20 H16 Au Cl10 O2 Tl
• Calculated formula: C20 H16 Au Cl10 O2 Tl
• Title of publication: A Detailed Study of the Vapochromic Behavior of {Tl[Au(C6Cl5)2]}n
• Authors of publication: Eduardo J. Fernández; José M. López-de-Luzuriaga; Miguel Monge; Manuel Montiel; M. Elena Olmos; Javier Pérez; Antonio Laguna; Fernando Mendizabal; Ahmed A. Mohamed; John P. Fackler
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 3573 - 3581
• a: 26.4163 ± 0.0006 Å
• b: 12.1619 ± 0.0002 Å
• c: 28.0813 ± 0.0006 Å
• α: 90°
• β: 161.982 ± 0.0006°
• γ: 90°
• Cell volume: 2790.52 ± 0.13 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0786
• Residual factor for significantly intense reflections: 0.0457
• Weighted residual factors for significantly intense reflections: 0.0826
• Weighted residual factors for all reflections included in the refinement: 0.0934
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No