Information card for entry 4338133

Structure parameters

• Formula: C49 H43 Au Fe O0.5 P2 S2
• Calculated formula: C49 H43 Au Fe O0.5 P2 S2
• Title of publication: High-coordinate gold(i) complexes with dithiocarboxylate ligands.
• Authors of publication: Kaub, Christoph; Augenstein, Timo; Bauer, Thomas O.; Rothe, Elisa; Esmezjan, Lars; Schünemann, Volker; Roesky, Peter W.
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 9
• Pages of publication: 4491 - 4499
• a: 12.348 ± 0.003 Å
• b: 13.089 ± 0.003 Å
• c: 15.366 ± 0.003 Å
• α: 97.82 ± 0.03°
• β: 95.82 ± 0.03°
• γ: 113.23 ± 0.03°
• Cell volume: 2227.9 ± 1.1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0454
• Residual factor for significantly intense reflections: 0.031
• Weighted residual factors for significantly intense reflections: 0.077
• Weighted residual factors for all reflections included in the refinement: 0.1051
• Goodness-of-fit parameter for all reflections included in the refinement: 1.092
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No