Information card for entry 4305162

Structure parameters

• Formula: C38 H28 Cl6 N8 O6 Ru
• Calculated formula: C38 H30 Cl6 N8 O6 Ru
• SMILES: [Ru]123(n4c(nc5c4cccc5)c4[n]1c1c([nH]4)cccc1)([n]1c(c4[n]2cccc4)cccc1)[n]1ccccc1c1[n]3cccc1.ClC(Cl)(Cl)C(=O)O.ClC(Cl)(Cl)C(=O)[O-].O.O
• Title of publication: Ruthenium(II) 2,2'-Bibenzimidazole Complex as a Second-Sphere Receptor for Anions Interaction and Colorimeter
• Authors of publication: Ying Cui; Yan-Li Niu; Man-Li Cao; Ke Wang; Hao-Jun Mo; Yong-Rui Zhong; Bao-Hui Ye
• Journal of publication: Inorganic Chemistry
• Year of publication: 2008
• Journal volume: 47
• Pages of publication: 5616 - 5624
• a: 9.9014 ± 0.001 Å
• b: 11.7351 ± 0.0012 Å
• c: 18.913 ± 0.002 Å
• α: 88.102 ± 0.002°
• β: 74.916 ± 0.002°
• γ: 75.501 ± 0.002°
• Cell volume: 2053.1 ± 0.4 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: 0.0764
• Residual factor for significantly intense reflections: 0.0515
• Weighted residual factors for significantly intense reflections: 0.1034
• Weighted residual factors for all reflections included in the refinement: 0.1278
• Goodness-of-fit parameter for all reflections included in the refinement: 1.008
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No