Information card for entry 7227223

Structure parameters

• Formula: C30 H32 B Cl F4 N4 Ru
• Calculated formula: C30 H32 B Cl F4 N4 Ru
• SMILES: [n]12c(n3c(c1c1[n](cccc1)[Ru]145672([c]2([cH]4[cH]7[c]1([cH]5[cH]62)C(C)C)C)Cl)cccc3)c1ccc(N(C)C)cc1.[B](F)(F)(F)[F-]
• Title of publication: Synthesis, Structures, and DNA and Protein Binding of Ruthenium(II)-p-Cymene Complexes of Substituted Pyridylimidazo[1,5-a]pyridine: Enhanced Cytotoxicity of Complexes of Ligands Appended with Carbazole Moiety
• Authors of publication: Khamrang, Themmila; Kartikeyan, Radhakrishnan; Velusamy, Marappan; Rajendiran, Venugopal; R, Dhivya; Perumalsamy, Balaji; M. A., Akbarsha; Palaniandavar, Mallayan
• Journal of publication: RSC Adv.
• Year of publication: 2016
• a: 15.9526 ± 0.0005 Å
• b: 7.7424 ± 0.0003 Å
• c: 24.6748 ± 0.001 Å
• α: 90°
• β: 106.237 ± 0.004°
• γ: 90°
• Cell volume: 2926.1 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• 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: 0.0564
• Residual factor for significantly intense reflections: 0.0426
• Weighted residual factors for significantly intense reflections: 0.0932
• Weighted residual factors for all reflections included in the refinement: 0.1013
• Goodness-of-fit parameter for all reflections included in the refinement: 1.092
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No