Information card for entry 8101560

Structure parameters

• Formula: C12 H14 Cl2 O3 Sn W
• Calculated formula: C12 H14 Cl2 O3 Sn W
• SMILES: [W]1234([Sn](Cl)(Cl)C(C)(C)C)(C#[O])(C#[O])(C#[O])[cH]5[cH]4[cH]3[cH]2[cH]15
• Title of publication: Crystal structure of tert-butyl-1κC-2-(η^5^-cyclopentadienyl) dichloro-1κ^2^Cl-tricarbonyl-2κ^3^C-tintungsten (S‒W), tert-Bu[Cp(CO)~3~W]SnCl~2~
• Authors of publication: Jurkschat, Klaus; Kaltenbrunner, Ulrich; Schürmann, Markus
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 1999
• Journal volume: 214
• Journal issue: 4
• Pages of publication: 473 - 474
• a: 7.59 ± 0.001 Å
• b: 9.083 ± 0.001 Å
• c: 12.786 ± 0.001 Å
• α: 75.448 ± 0.001°
• β: 80.461 ± 0.001°
• γ: 80.326 ± 0.001°
• Cell volume: 834 ± 0.2 ų
• Cell temperature: 291 ± 1 K
• Ambient diffraction temperature: 170 ± 1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.04
• Weighted residual factors for significantly intense reflections: 0.0988
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No