Information card for entry 4313733

Structure parameters

• Formula: C38 H32 F10 K O17 P W2
• Calculated formula: C38 H24 F10 K O17 P W2
• SMILES: [W](C#[O])(C#[O])(C#[O])(C#[O])(C#[O])[P]([W](C#[O])(C#[O])(C#[O])(C#[O])C#[O])(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F.[K]12345([O]6CC[O]5CC[O]4CC[O]3CC[O]2CC[O]1CC6)[O]1CCCC1
• Title of publication: Stabilization of the P(CF~3~)~2~^-^ and P(C~6~F~5~)~2~^-^ Ions by Coordination to Pentacarbonyl Tungsten: Structures of [18-crown-6-K]P(CF~3~)~2~, [18-crown-6-K][W{P(CF~3~)~2~}(CO)~5~] and [18-crown-6-K][{W(CO)~5~}~2~{μ-P(C~6~F~5~)~2~}].THF
• Authors of publication: Berthold Hoge; Christoph Thösen; Tobias Herrmann; Ingo Pantenburg
• Journal of publication: Inorganic Chemistry
• Year of publication: 2003
• Journal volume: 42
• Pages of publication: 3633 - 3641
• a: 9.1723 ± 0.0011 Å
• b: 15.56 ± 0.002 Å
• c: 17.007 ± 0.002 Å
• α: 81.961 ± 0.01°
• β: 87.452 ± 0.01°
• γ: 75.429 ± 0.01°
• Cell volume: 2326 ± 0.5 ų
• Cell temperature: 170 ± 2 K
• Ambient diffraction temperature: 170 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0838
• Residual factor for significantly intense reflections: 0.0395
• Weighted residual factors for significantly intense reflections: 0.0781
• Weighted residual factors for all reflections included in the refinement: 0.0898
• Goodness-of-fit parameter for all reflections included in the refinement: 0.824
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No