Information card for entry 7118243

Structure parameters

• Chemical name: Carbonyl-diiodacetylene-dimethylaminopyridine-hydridotris(3,5-dimethylpyrazolylborato)tungsten(II)-hexafluorophosphate
• Formula: C25 H32 B F6 I2 N8 O P W
• Calculated formula: C25 H32 B F6 I2 N8 O P W
• Title of publication: Dual nucleophilic substitution at a W(ii) η(2)-coordinated diiodo acetylene leading to an amidinium carbyne complex.
• Authors of publication: Helmdach, Kai; Rüger, Julia; Villinger, Alexander; Seidel, Wolfram W.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2016
• Journal volume: 52
• Journal issue: 12
• Pages of publication: 2616 - 2619
• a: 8.352 ± 0.0002 Å
• b: 22.5729 ± 0.0006 Å
• c: 18.2914 ± 0.0005 Å
• α: 90°
• β: 100.772 ± 0.002°
• γ: 90°
• Cell volume: 3387.69 ± 0.15 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 9
• 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: 0.1608
• Residual factor for significantly intense reflections: 0.0635
• Weighted residual factors for significantly intense reflections: 0.1022
• Weighted residual factors for all reflections included in the refinement: 0.1327
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No