Information card for entry 7111235

Structure parameters

• Formula: C14 H28 Cl2 N2 Ru
• Calculated formula: C14 H28 Cl2 N2 Ru
• SMILES: C1[NH](CC)[Ru]234([CH]5CC[CH]4=[CH]3CC[CH]2=5)(Cl)([NH](C1)CC)Cl
• Title of publication: Intramolecular dealkylation of chelating diamines with Ru(ii) complexes
• Authors of publication: Morilla, M. Esther; Morfes, Galanda; Nicasio, M. Carmen; Belderrain, Tomás R.; Díaz-Requejo, M. Mar; Graiff, Claudia; Tiripicchio, Antonio; Sánchez-Delgado, Roberto; Pérez, Pedro J.
• Journal of publication: Chemical Communications
• Year of publication: 2002
• Journal issue: 17
• Pages of publication: 1848 - 1849
• a: 10.548 ± 0.005 Å
• b: 15.762 ± 0.005 Å
• c: 10.797 ± 0.005 Å
• α: 90°
• β: 106.12 ± 0.05°
• γ: 90°
• Cell volume: 1724.5 ± 1.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0361
• Residual factor for significantly intense reflections: 0.0321
• Weighted residual factors for significantly intense reflections: 0.0853
• Weighted residual factors for all reflections included in the refinement: 0.0887
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No