Information card for entry 4342002

Structure parameters

• Formula: C42 H29 Cl2 N7 O9 Os
• Calculated formula: C42 H29 Cl2 N7 O9 Os
• SMILES: [Os]123([n]4c(c5[n]2cccc5)cccc4)([n]2c(cccc2)c2[nH]c4c([n]12)c1cccc2c1c1c(cccc41)cc2)[n]1c(cccc1)c1[n]3cccc1.Cl(=O)(=O)(=O)[O-].Cl(=O)(=O)(=O)[O-].O
• Title of publication: Ruthenium(II) and Osmium(II) Mixed Chelates Based on Pyrenyl-Pyridylimidazole and 2,2'-Bipyridine Ligands as Efficient DNA Intercalators and Anion Sensors.
• Authors of publication: Mardanya, Sourav; Karmakar, Srikanta; Maity, Dinesh; Baitalik, Sujoy
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 2
• Pages of publication: 513 - 526
• a: 10.6769 ± 0.0003 Å
• b: 12.2564 ± 0.0003 Å
• c: 15.1793 ± 0.0004 Å
• α: 90.466 ± 0.001°
• β: 100.855 ± 0.001°
• γ: 90.176 ± 0.001°
• Cell volume: 1950.74 ± 0.09 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0431
• Residual factor for significantly intense reflections: 0.0378
• Weighted residual factors for significantly intense reflections: 0.108
• Weighted residual factors for all reflections included in the refinement: 0.1221
• Goodness-of-fit parameter for all reflections included in the refinement: 0.978
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No