Information card for entry 1543551

Structure parameters

• Formula: C6 H19 B F10 N6 O4 Ru Si
• Calculated formula: C6 H19 B F10 N6 O4 Ru Si
• SMILES: [Ru](N=O)([n]1ccc(C(=O)O)cc1)([NH3])([NH3])([NH3])[NH3].[Si](F)(F)(F)(F)([F-])[F-].[B](F)(F)(F)[F-].O
• Title of publication: PAMAM dendrimers functionalized with ruthenium nitrosyl as nitric oxide carriers
• Authors of publication: Antonio Carlos Roveda Jr.; Thiago Bueno Ruiz Papa; Eduardo Ernesto Castellano; Douglas Wagner Franco
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2014
• Pages of publication: 147 - 155
• a: 7.9616 ± 0.0002 Å
• b: 24.3982 ± 0.0008 Å
• c: 9.9705 ± 0.0003 Å
• α: 90°
• β: 98.781 ± 0.002°
• γ: 90°
• Cell volume: 1914.06 ± 0.1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0626
• Residual factor for significantly intense reflections: 0.0473
• Weighted residual factors for significantly intense reflections: 0.1153
• Weighted residual factors for all reflections included in the refinement: 0.1246
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No