Information card for entry 4341135

Structure parameters

• Formula: C30 H23 Cl N6 O6 Os
• Calculated formula: C30 H23 Cl N6 O6 Os
• SMILES: [Os]123([n]4c(c([O-])ccc4)c4[n]3cccc4O)([n]3ccccc3c3[n]1cccc3)[n]1ccccc1c1[n]2cccc1.Cl(=O)(=O)(=O)[O-]
• Title of publication: Revelation of Varying Coordination Modes and Noninnocence of Deprotonated 2,2'-Bipyridine-3,3'-diol in {Os(bpy)2} Frameworks.
• Authors of publication: Ghosh, Prabir; Ray, Ritwika; Das, Ankita; Lahiri, Goutam Kumar
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 19
• Pages of publication: 10695 - 10707
• a: 8.899 ± 0.011 Å
• b: 11.948 ± 0.014 Å
• c: 15.427 ± 0.019 Å
• α: 96.098 ± 0.015°
• β: 105.56 ± 0.03°
• γ: 93.292 ± 0.019°
• Cell volume: 1565 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0749
• Residual factor for significantly intense reflections: 0.0658
• Weighted residual factors for significantly intense reflections: 0.1749
• Weighted residual factors for all reflections included in the refinement: 0.1858
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No