Information card for entry 1544776

Structure parameters

• Common name: RuCl(NCO)(DMSO)(Pic)
• Chemical name: Ru WOCs
• Formula: C41 H52 Cl8 N8 O6 Ru2 S2
• Calculated formula: C41 H52 Cl8 N8 O6 Ru2 S2
• Title of publication: Chemical and photochemical water oxidation catalyzed by novel ruthenium complexes comprising a negatively charged NCNHCO ligand
• Authors of publication: Su, Wei; Younus, Hussein A.; Zhou, Kui; Khattak, Zafar A. K.; Chaemcheun, Somboon; Chen, Cheng; Verpoort, Francis
• Journal of publication: Catal. Sci. Technol.
• Year of publication: 2017
• Journal volume: 7
• Journal issue: 2
• Pages of publication: 387
• a: 31.425 ± 0.006 Å
• b: 9.0156 ± 0.0018 Å
• c: 34.41 ± 0.005 Å
• α: 90°
• β: 147.193 ± 0.008°
• γ: 90°
• Cell volume: 5282 ± 2 ų
• Cell temperature: 297 K
• Ambient diffraction temperature: 297 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0683
• Residual factor for significantly intense reflections: 0.0636
• Weighted residual factors for significantly intense reflections: 0.1487
• Weighted residual factors for all reflections included in the refinement: 0.1517
• Goodness-of-fit parameter for all reflections included in the refinement: 1.233
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No