Information card for entry 2227626

Structure parameters

• Chemical name: Undecacarbonyl-1κ^3^<i>C</i>,2κ^4^<i>C</i>,3κ^4^<i>C</i>- [tris(2-chloroethyl) phosphite-1κ<i>P</i>]-<i>triangulo</i>-triruthenium(0)
• Formula: C17 H12 Cl3 O14 P Ru3
• Calculated formula: C17 H12 Cl3 O14 P Ru3
• SMILES: [Ru]1([Ru]([Ru]1(C#[O])(C#[O])(C#[O])C#[O])(C#[O])(C#[O])(C#[O])C#[O])([P](OCCCl)(OCCCl)OCCCl)(C#[O])(C#[O])C#[O]
• Title of publication: Undecacarbonyl-1κ^3^<i>C</i>,2κ^4^<i>C</i>,3κ^4^<i>C</i>-[tris(2-chloroethyl) phosphite-1κ<i>P</i>]-<i>triangulo</i>-triruthenium(0)
• Authors of publication: bin Shawkataly, Omar; Ghani, Syed Sauban; Jothiramalingam, Rajabathar; Yeap, Chin Sing; Fun, Hoong-Kun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 10
• Pages of publication: m1191 - m1192
• a: 7.8592 ± 0.0009 Å
• b: 12.5979 ± 0.0014 Å
• c: 14.8393 ± 0.0017 Å
• α: 109.442 ± 0.003°
• β: 93.791 ± 0.003°
• γ: 90.763 ± 0.003°
• Cell volume: 1381.4 ± 0.3 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 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 all reflections: 0.0427
• Residual factor for significantly intense reflections: 0.0303
• Weighted residual factors for significantly intense reflections: 0.0821
• Weighted residual factors for all reflections included in the refinement: 0.1195
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes