Information card for entry 7008235

Structure parameters

• Common name: (Cu(3)(H2O))SO4-5.5(H2O)
• Formula: C17 H29 Cu N6 O10.5 S
• Calculated formula: C17 H18 Cu N6 O10.5 S
• Title of publication: Syntheses, crystal structures and properties of novel copper(II) complexes obtained by reactions of copper(II) sulfate pentahydrate with tripodal ligands.
• Authors of publication: Zhao, Wei; Fan, Jian; Song, You; Kawaguchi, Hiroyuki; Okamura, Taka-aki; Sun, Wei-Yin; Ueyama, Norikazu
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2005
• Journal issue: 8
• Pages of publication: 1509 - 1517
• a: 8.01 ± 0.005 Å
• b: 11.542 ± 0.004 Å
• c: 13.09 ± 0.005 Å
• α: 83.533 ± 0.017°
• β: 86.67 ± 0.03°
• γ: 83.22 ± 0.03°
• Cell volume: 1192.8 ± 1 ų
• Cell temperature: 200 K
• Ambient diffraction temperature: 200 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: 0.0778
• Residual factor for significantly intense reflections: 0.0529
• Weighted residual factors for significantly intense reflections: 0.1233
• Weighted residual factors for all reflections included in the refinement: 0.1449
• Goodness-of-fit parameter for all reflections included in the refinement: 0.83
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No