Information card for entry 7000455

Structure parameters

• Common name: K(Ru(NO)Cl3(KojH-1))
• Formula: C6 H5 Cl3 K N O5 Ru
• Calculated formula: C6 H5 Cl3 K N O5 Ru
• SMILES: [Ru]1(Cl)(Cl)(Cl)([O]=C2C=C(OC=C2O1)CO)N=O.[K+]
• Title of publication: Photoinduced linkage isomerism of {RuNO}6 complexes with bioligands and related chelators
• Authors of publication: Zangl, Anna; Klüfers, Peter; Schaniel, Dominik; Woike, Theo
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 6
• Pages of publication: 1034 - 1045
• a: 6.7023 ± 0.0002 Å
• b: 9.6661 ± 0.0004 Å
• c: 10.7942 ± 0.0005 Å
• α: 71.876 ± 0.002°
• β: 84.927 ± 0.003°
• γ: 73.877 ± 0.002°
• Cell volume: 638.47 ± 0.05 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0385
• Residual factor for significantly intense reflections: 0.0288
• Weighted residual factors for significantly intense reflections: 0.0644
• Weighted residual factors for all reflections included in the refinement: 0.0686
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No