Information card for entry 7113604

Structure parameters

• Formula: C18 H11 I O5 Os
• Calculated formula: C18 H11 I O5 Os
• SMILES: [Os]1(I)([O]=C(c2ccccc2)C=C(O1)c1ccccc1)(C#[O])(C#[O])C#[O]
• Title of publication: Synthesis and characterization of luminescent osmium(II) carbonyl complexes based on chelating dibenzoylmethanate and halide ligands
• Authors of publication: Chen, Yao-Lun; Sinha, Chittaranjan; Chen, I-Chia; Liu, Kuan-Lin; Chi, Yun; Yu, Jen-Kan; Chou, Pi-Tai; Lu, Tian-Huey
• Journal of publication: Chemical Communications (Cambridge, United Kingdom)
• Year of publication: 2003
• Journal issue: 24
• Pages of publication: 3046 - 3047
• a: 9.5934 ± 0.0006 Å
• b: 10.4791 ± 0.0007 Å
• c: 37.126 ± 0.002 Å
• α: 90°
• β: 93.863 ± 0.001°
• γ: 90°
• Cell volume: 3723.8 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.0855
• Residual factor for significantly intense reflections: 0.045
• Weighted residual factors for significantly intense reflections: 0.0772
• Weighted residual factors for all reflections included in the refinement: 0.0848
• Goodness-of-fit parameter for all reflections included in the refinement: 0.965
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Duplicate of: 7103903
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No