Information card for entry 7003737

Structure parameters

• Formula: C20 H32 Cl2 N6 O15 Ru
• Calculated formula: C20 H32 Cl2 N6 O15 Ru
• SMILES: C1(COC2C3OCC(C)(C)[N]=3[Ru]3([N]1=2)([N]1C(COC=1C1=[N]3C(CO1)(C)C)(C)C)(N(=O)=O)N=O)(C)C.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O
• Title of publication: Use of HNO3 as the source of NO to prepare a nitric oxide complex of ruthenium
• Authors of publication: Drew, Michael G. B.; Nag, Samik; Datta, Dipankar
• Journal of publication: Dalton Transactions
• Year of publication: 2008
• Journal issue: 17
• Pages of publication: 2298 - 2302
• a: 14.054 ± 0.005 Å
• b: 14.903 ± 0.004 Å
• c: 15.135 ± 0.002 Å
• α: 75.339 ± 0.016°
• β: 85.209 ± 0.018°
• γ: 82.35 ± 0.03°
• Cell volume: 3035.4 ± 1.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.188
• Residual factor for significantly intense reflections: 0.1153
• Weighted residual factors for significantly intense reflections: 0.258
• Weighted residual factors for all reflections included in the refinement: 0.289
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No