Information card for entry 7053304

Structure parameters

• Common name: cocrystallisate of pentacarbonyl(hydroxy(2-(1- piperidyl)thiazol-5- yl)methylidene)tungsten and tetramethylammonium pentacarbonyl((2-(1- piperidyl)thiazol-5-yl)carbonyl)tungstate(1-) bis- trichloromethane solvate
• Chemical name: cocrystallisate of pentacarbonyl{hydroxy[2-(1-piperidyl)thiazol- 5-yl]methylidene}tungsten and tetramethylammonium pentacarbonyl{[2-(1-piperidyl)thiazol-5-yl]carbonyl}tungstate(1-) bis-trichloromethane solvate
• Formula: C34 H37 Cl6 N5 O12 S2 W2
• Calculated formula: C34 H37 Cl6 N5 O12 S2 W2
• 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: 26.273 ± 0.007 Å
• b: 11.491 ± 0.003 Å
• c: 16.925 ± 0.005 Å
• α: 90°
• β: 111.94 ± 0.004°
• γ: 90°
• Cell volume: 4740 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• 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: 0.0731
• Residual factor for significantly intense reflections: 0.0525
• Weighted residual factors for significantly intense reflections: 0.1153
• Weighted residual factors for all reflections included in the refinement: 0.1245
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No