Information card for entry 7016358

Structure parameters

• Formula: C46 H57 O11 P3 Sn W
• Calculated formula: C46 H57 O11 P3 Sn W
• SMILES: [W]([Sn]12(P(c3ccccc3)c3ccccc3)[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].c1(ccccc1)C
• 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: 11.3682 ± 0.0003 Å
• b: 23.9843 ± 0.0006 Å
• c: 18.4609 ± 0.0005 Å
• α: 90°
• β: 95.285 ± 0.002°
• γ: 90°
• Cell volume: 5012.1 ± 0.2 ų
• Cell temperature: 173 ± 1 K
• Ambient diffraction temperature: 173 ± 1 K
• Number of distinct elements: 6
• 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: 0.0333
• Residual factor for significantly intense reflections: 0.0215
• Weighted residual factors for significantly intense reflections: 0.0414
• Weighted residual factors for all reflections included in the refinement: 0.0422
• Goodness-of-fit parameter for all reflections included in the refinement: 0.905
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No