Information card for entry 7710167

Structure parameters

• Chemical name: Tetrachloro(1,2-dimethoxyethane)tungsten(IV)
• Formula: C4 H10 Cl4 O2 W
• Calculated formula: C4 H10 Cl4 O2 W
• SMILES: [W]1(Cl)(Cl)(Cl)(Cl)[O](CC[O]1C)C
• Title of publication: Synthesis, Characterization, X-ray and Electronic Structures of Diethyl Ether and 1,2-Dimethoxyethane Adducts of Molybdenum(IV) Chloride and Tungsten(IV) Chloride
• Authors of publication: Shaw, Thomas E.; Diethrich, Timothy J. J.; Stern, Charlotte L.; Scott, Brian; Jurca, Titel; Gilbert, Thomas M.; Sattelberger, Alfred P.
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 8.0766 ± 0.0002 Å
• b: 11.3089 ± 0.0002 Å
• c: 11.7413 ± 0.0003 Å
• α: 90°
• β: 90.687 ± 0.002°
• γ: 90°
• Cell volume: 1072.34 ± 0.04 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100.15 K
• Number of distinct elements: 5
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0236
• Residual factor for significantly intense reflections: 0.0224
• Weighted residual factors for significantly intense reflections: 0.0555
• Weighted residual factors for all reflections included in the refinement: 0.0558
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No