Information card for entry 7218043

Structure parameters

• Formula: C39 H29 Cl N3 O4 P Ru
• Calculated formula: C39 H29 Cl N3 O4 P Ru
• SMILES: [Ru]1([P](c2ccccc2)(c2ccccc2)c2ccccc2)(Oc2c(c3c(cc2)cccc3)C=[N]1c1c2c(cccc2)ccc1)(N=O)(Cl)N(=O)=O
• Title of publication: Reactivity of nitric oxide with ruthenium complexes derived from bidentate ligands: Structure of ruthenium nitrosyl complex, photoinduced generation and estimation of nitric oxide
• Authors of publication: Ghosh, Kaushik; Kumar, Rajan; Kumar, Kapil; Ratnam, Anand; Singh, Udai
• Journal of publication: RSC Adv.
• Year of publication: 2014
• a: 9.136 ± 0.004 Å
• b: 11.058 ± 0.004 Å
• c: 18.192 ± 0.007 Å
• α: 102.36 ± 0.02°
• β: 90.79 ± 0.03°
• γ: 107.76 ± 0.03°
• Cell volume: 1703.5 ± 1.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1384
• Residual factor for significantly intense reflections: 0.075
• Weighted residual factors for significantly intense reflections: 0.1828
• Weighted residual factors for all reflections included in the refinement: 0.2123
• Goodness-of-fit parameter for all reflections included in the refinement: 1.188
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No