Information card for entry 2009334

Structure parameters

• Chemical name: Perchlorato[(5RS,9SR)-1,5,9,13-tetraazatridecane]copper(II) perchlorate
• Formula: C9 H24 Cl2 Cu N4 O8
• Calculated formula: C9 H24 Cl2 Cu N4 O8
• SMILES: C1CC[NH]2CCC[NH]3CCC[NH2][Cu]23([NH2]1)OCl(=O)(=O)=O.[O-]Cl(=O)(=O)=O
• Title of publication: [(5<i>RS</i>,9<i>SR</i>)-4,8-Diazaundecane-1,11-diamine](perchlorato-<i>O</i>,<i>O</i>')copper(II) perchlorate
• Authors of publication: Panneerselvam, Kaliyamoorthy; Lu, Tian-Huey; Chi, Ta-Yung; Tung, Shu-Fang; Chung, Chung-Sun
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 12
• Pages of publication: IUC9900172
• a: 15.758 ± 0.003 Å
• b: 15.306 ± 0.002 Å
• c: 14.496 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3496.3 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.165
• Residual factor for significantly intense reflections: 0.058
• Weighted residual factors for all reflections included in the refinement: 0.164
• Goodness-of-fit parameter for all reflections included in the refinement: 0.955
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes