Information card for entry 4077539

Structure parameters

• Formula: C41 H28 N2 O9 Os3
• Calculated formula: C41 H28 N2 O9 Os3
• SMILES: [Os]123([Os]([H]3)([Os]1(C#[O])(C#[O])(C#[O])C#[O])(C#[O])(C#[O])(C#[O])[NH]2C(c1ccccc1)c1ccccc1)(C#[O])(C#[O])[NH]=C(c1ccccc1)c1ccccc1.c1ccccc1
• Title of publication: Approaches to Triosmium Carbonyl Cluster Compounds Derived from Benzophenone Imine. Characterization of Terminal Imino, Bridging Amido, and Orthometalated Imino Derivatives
• Authors of publication: Cabeza, Javier A.; del Río, Ignacio; Grepioni, Fabrizia; Riera, Víctor
• Journal of publication: Organometallics
• Year of publication: 2000
• Journal volume: 19
• Journal issue: 22
• Pages of publication: 4643
• a: 11.029 ± 0.001 Å
• b: 12.278 ± 0.001 Å
• c: 15.922 ± 0.002 Å
• α: 101.681 ± 0.004°
• β: 106.035 ± 0.003°
• γ: 94.08 ± 0.004°
• Cell volume: 2010.7 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1284
• Residual factor for significantly intense reflections: 0.0505
• Weighted residual factors for significantly intense reflections: 0.0982
• Weighted residual factors for all reflections included in the refinement: 0.1147
• Goodness-of-fit parameter for all reflections included in the refinement: 0.807
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No