Information card for entry 7013155

Structure parameters

• Formula: C43 H45 Cl N7 O4 Ru
• Calculated formula: C43 H39 Cl N7 O4 Ru
• SMILES: [Ru]12(OC(Cc3[n]2c(ccc3)CC(O1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)([n]1[nH]ccc1)([n]1[nH]ccc1)[n]1[nH]ccc1.[Cl-].O.OC
• Title of publication: Nitrido-ruthenium(vi) and -osmium(vi) complexes of multianionic chelating (N, O) ligands. Reactions with nucleophiles, electrophiles and oxidizing agentsElectronic supplementary information (ESI) available: Fig. S1?S6. See http://www.rsc.org/suppdata/dt/b3/b304920p/
• Authors of publication: Yip, Ka-Lai; Yu, Wing-Yiu; Chan, Pui-Ming; Zhu, Nian-Yong; Che, Chi-Ming
• Journal of publication: Dalton Transactions
• Year of publication: 2003
• Journal issue: 18
• Pages of publication: 3556
• a: 9.621 ± 0.002 Å
• b: 35.268 ± 0.007 Å
• c: 11.953 ± 0.002 Å
• α: 90°
• β: 97.79 ± 0.03°
• γ: 90°
• Cell volume: 4018.4 ± 1.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0759
• Residual factor for significantly intense reflections: 0.0471
• Weighted residual factors for significantly intense reflections: 0.1251
• Weighted residual factors for all reflections included in the refinement: 0.1345
• Goodness-of-fit parameter for all reflections included in the refinement: 0.958
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No