Information card for entry 7016360

Structure parameters

• Formula: C27 H39 F O11 P2 Sn W
• Calculated formula: C27 H39 F O11 P2 Sn W
• SMILES: [W]([Sn]12(F)[O]=P(OC(C)C)(OC(C)C)c3c2c(P(=[O]1)(OC(C)C)OC(C)C)cc(c3)C(C)(C)C)(C#[O])(C#[O])(C#[O])(C#[O])C#[O]
• Title of publication: Intramolecularly coordinated heteroleptic organostannylene tungsten pentacarbonyl complexes 4-tBu-2,6-[P(O)(OiPr)(2)](2)C(6)H(2)Sn(X)W(CO)(5) (X = Cl, F, PPh(2), PPh(2)[W(CO)(5)]). Syntheses and reactivity.
• Authors of publication: Wagner, Michael; Dorogov, Konstantin; Schürmann, Markus; Jurkschat, Klaus
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 35
• Pages of publication: 8839 - 8848
• a: 10.6089 ± 0.0003 Å
• b: 11.7686 ± 0.0005 Å
• c: 15.4337 ± 0.0006 Å
• α: 78.061 ± 0.003°
• β: 72.319 ± 0.003°
• γ: 79.707 ± 0.003°
• Cell volume: 1782.26 ± 0.12 ų
• Cell temperature: 173 ± 1 K
• Ambient diffraction temperature: 173 ± 1 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: 0.0436
• Residual factor for significantly intense reflections: 0.0363
• Weighted residual factors for significantly intense reflections: 0.0903
• Weighted residual factors for all reflections included in the refinement: 0.0919
• Goodness-of-fit parameter for all reflections included in the refinement: 0.988
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No