Information card for entry 7112665

Structure parameters

• Formula: C44 H32 N4 O2 P Ru
• Calculated formula: C44 H32 N4 O2 P Ru
• SMILES: C(#N)[Ru]12([n]3c4c(ccc3)cccc4O1)(C#N)[n]1cccc3cccc(O2)c13.[P+](c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Novel heterobimetallic ruthenium(III)-cobalt(II) compounds constructed from trans-[Ru(III)(Q)2(CN)2](-) (Q = 8-quinolinolato): synthesis, structures and magnetic properties.
• Authors of publication: Xiang, Jing; Jia, Li-Hui; Man, Wai-Lun; Qian, Kang; Yiu, Shek-Man; Lee, Gene-Hsiang; Peng, Shie-Ming; Gao, Song; Lau, Tai-Chu
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2011
• Journal volume: 47
• Journal issue: 30
• Pages of publication: 8694 - 8696
• a: 16.4737 ± 0.001 Å
• b: 7.4234 ± 0.0005 Å
• c: 28.4371 ± 0.0016 Å
• α: 90°
• β: 93.451 ± 0.005°
• γ: 90°
• Cell volume: 3471.3 ± 0.4 ų
• Cell temperature: 173.15 K
• Ambient diffraction temperature: 173.15 K
• Number of distinct elements: 6
• 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: 0.0731
• Residual factor for significantly intense reflections: 0.0367
• Weighted residual factors for significantly intense reflections: 0.0699
• Weighted residual factors for all reflections included in the refinement: 0.0736
• Goodness-of-fit parameter for all reflections included in the refinement: 0.948
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No