Information card for entry 4305300

Structure parameters

• Formula: C32 H50 Cl2 N3 O2 Ru
• Calculated formula: C32 H50 Cl2 N3 O2 Ru
• SMILES: [Ru]123(Cl)(Cl)Oc4ccccc4C=[N]2CC[N]3=Cc2ccccc2O1.[N+](CCCC)(CCCC)(CCCC)CCCC
• Title of publication: General Synthesis of (Salen)ruthenium(III) Complexes via N...N Coupling of (Salen)ruthenium(VI) Nitrides
• Authors of publication: Wai-Lun Man; Hoi-Ki Kwong; William W. Y. Lam; Jing Xiang; Tsz-Wing Wong; Wing-Hong Lam; Wing-Tak Wong; Shie-Ming Peng; Tai-Chu Lau
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 5936 - 5944
• a: 11.817 ± 0.003 Å
• b: 13.209 ± 0.003 Å
• c: 22.033 ± 0.004 Å
• α: 90°
• β: 97.762 ± 0.019°
• γ: 90°
• Cell volume: 3407.6 ± 1.3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1195
• Residual factor for significantly intense reflections: 0.0572
• Weighted residual factors for significantly intense reflections: 0.1574
• Weighted residual factors for all reflections included in the refinement: 0.1926
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No