Information card for entry 7038729

Structure parameters

• Formula: C24 H14 O10 Os3 Te2
• Calculated formula: C24 H14 O10 Os3 Te2
• SMILES: C(#[O])[Os]1(C#[O])([Os]2(C#[O])(C#[O])(C#[O])[Te](c3ccc(C)cc3)[Os]1(C#[O])(C#[O])(C#[O])[Te]2c1ccc(C)cc1)(C#[O])C#[O]
• Title of publication: Isomerization of the osmium-tellurium cluster Os3(μ-TeR)2(CO)10: a kinetic and computational study.
• Authors of publication: Shim, E. K. S.; Leong, W. K.; Li, Y.-Z.; Richmond, M. G.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 16
• Pages of publication: 7158 - 7162
• a: 14.1313 ± 0.0006 Å
• b: 14.1313 ± 0.0006 Å
• c: 28.8408 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5759.3 ± 0.4 ų
• Cell temperature: 103 ± 2 K
• Ambient diffraction temperature: 103 ± 2 K
• Number of distinct elements: 5
• Space group number: 122
• Hermann-Mauguin space group symbol: I -4 2 d
• Hall space group symbol: I -4 2bw
• Residual factor for all reflections: 0.018
• Residual factor for significantly intense reflections: 0.0168
• Weighted residual factors for significantly intense reflections: 0.0355
• Weighted residual factors for all reflections included in the refinement: 0.0358
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No