Information card for entry 4321454

Structure parameters

• Common name: [Co(cyclen)(1,2-diaminoethane)](ClO4)3
• Formula: C10 H28 Cl3 Co N6 O12
• Calculated formula: C10 H28 Cl3 Co N6 O12
• Title of publication: Kinetic Origin of the Chelate Effect. Base Hydrolysis, H-Exchange Reactivity, and Structures of syn,anti-[Co(cyclen)(NH3)2]3+ and syn,anti-[Co(cyclen)(diamine)]3+ Ions (diamine = H2N(CH2)2NH2, H2N(CH2)3NH2)
• Authors of publication: Andrea J. Clarkson; David A. Buckingham; Andrew J. Rogers; Allan G. Blackman; Charles R. Clark
• Journal of publication: Inorganic Chemistry
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 4769 - 4775
• a: 8.892 ± 0.002 Å
• b: 15.285 ± 0.003 Å
• c: 15.466 ± 0.003 Å
• α: 90°
• β: 91.05 ± 0.03°
• γ: 90°
• Cell volume: 2101.7 ± 0.7 ų
• Cell temperature: 149 ± 2 K
• Ambient diffraction temperature: 149 ± 2 K
• Number of distinct elements: 6
• 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: 0.0715
• Residual factor for significantly intense reflections: 0.0657
• Weighted residual factors for significantly intense reflections: 0.1622
• Weighted residual factors for all reflections included in the refinement: 0.1666
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No