Information card for entry 7053301

Structure parameters

• Common name: pentacarbonyl-2kappa$5!C-(mu-(2-phenylthiazol-5-yl)carbonyl- 1kappaC:2kappaO)(triphenylphosphane-1kappaP)goldtungsten pentane solvate
• Chemical name: pentacarbonyl-2κ^5^C-[μ-(2-phenylthiazol-5-yl)carbonyl- 1κC:2κO](triphenylphosphane-1κP)goldtungsten pentane solvate
• Formula: C38 H33 Au N O6 P S W
• Calculated formula: C38 H33 Au N O6 P S W
• SMILES: [Au]([P](c1ccccc1)(c1ccccc1)c1ccccc1)C(=[O][W](C#[O])(C#[O])(C#[O])(C#[O])C#[O])c1sc(nc1)c1ccccc1.CCCCC
• Title of publication: Fischer-type tungsten acyl (carbeniate), carbene and carbyne complexes bearing C5-attached thiazolyl substituents: interaction with gold(i) fragments
• Authors of publication: Strasser, Christoph E.; Cronje, Stephanie; Raubenheimer, Helgard G.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2010
• Journal volume: 34
• Journal issue: 3
• Pages of publication: 458
• a: 11.5111 ± 0.0007 Å
• b: 12.0437 ± 0.0008 Å
• c: 13.8342 ± 0.0009 Å
• α: 100.005 ± 0.001°
• β: 102.85 ± 0.001°
• γ: 94.026 ± 0.001°
• Cell volume: 1829.6 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0473
• Residual factor for significantly intense reflections: 0.0397
• Weighted residual factors for significantly intense reflections: 0.087
• Weighted residual factors for all reflections included in the refinement: 0.0898
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No