Information card for entry 1564894

Structure parameters

• Formula: C45 H36 N7 O4 Os P
• Calculated formula: C45 H36 N7 O4 Os P
• SMILES: [Os]1([n]2c3ccccc3oc2c2cc(N(=O)=O)ccc2O1)(N=C(C)C)(C#N)(C#N)C#N.[P+](c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1.N#CC
• Title of publication: Visible Light-Induced Oxidative N-dealkylation of Alkylamines by a Luminescent Osmium(VI) Nitrido Complex
• Authors of publication: Lau, Tai-Chu; Xiang, Jing; Ming, Peng; Yi, PAN; Luo, Li-Juan; Cheng, Shun-Cheung; Jin, XinXin; Yiu, Shek-Man; Man, Wai-Lun; Ko, Chi-Chiu; LAU, Kai Chung
• Journal of publication: Chemical Science
• Year of publication: 2021
• a: 7.541 ± 0.004 Å
• b: 16.41 ± 0.009 Å
• c: 17.308 ± 0.01 Å
• α: 108.857 ± 0.01°
• β: 93.523 ± 0.01°
• γ: 91.599 ± 0.009°
• Cell volume: 2020.5 ± 1.9 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 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: 0.0625
• Residual factor for significantly intense reflections: 0.046
• Weighted residual factors for significantly intense reflections: 0.1258
• Weighted residual factors for all reflections included in the refinement: 0.1823
• Goodness-of-fit parameter for all reflections included in the refinement: 1.184
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No