Information card for entry 7024604

Structure parameters

• Formula: C91 H100 Au2 Cl2 N12 O3 P4 S4
• Calculated formula: C91 H100 Au2 Cl2 N12 O3 P4 S4
• Title of publication: A thiosemicarbazone ligand functionalized by a phosphine group: reactivity toward coinage metal ions.
• Authors of publication: Castiñeiras, Alfonso; Pedrido, Rosa
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 15
• Pages of publication: 3572 - 3584
• a: 26.2369 ± 0.0003 Å
• b: 13.3291 ± 0.0002 Å
• c: 28.3901 ± 0.0004 Å
• α: 90°
• β: 109.888 ± 0.001°
• γ: 90°
• Cell volume: 9336.3 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0531
• Residual factor for significantly intense reflections: 0.0365
• Weighted residual factors for significantly intense reflections: 0.0809
• Weighted residual factors for all reflections included in the refinement: 0.0847
• Goodness-of-fit parameter for all reflections included in the refinement: 1.164
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No