Information card for entry 4338134

Structure parameters

• Formula: C61 H53 Au2 Cl Fe P4 S2
• Calculated formula: C61 H53 Au2 Cl Fe P4 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: 11.666 ± 0.0003 Å
• b: 22.0215 ± 0.0004 Å
• c: 23.4212 ± 0.0005 Å
• α: 90°
• β: 95.9479 ± 0.0018°
• γ: 90°
• Cell volume: 5984.6 ± 0.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0452
• Residual factor for significantly intense reflections: 0.0308
• Weighted residual factors for significantly intense reflections: 0.0655
• Weighted residual factors for all reflections included in the refinement: 0.0687
• Goodness-of-fit parameter for all reflections included in the refinement: 0.923
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No