Information card for entry 7005201

Structure parameters

• Formula: C24 H34 Cl Cu N5 O6
• Calculated formula: C24 H34 Cl Cu N5 O6
• Title of publication: New dioxadiaza- and trioxadiaza-macrocycles containing one dibenzofuran unit with two amino pendant arms: synthesis, protonation and complexation studies.
• Authors of publication: Li, Feng; Li, Li; Delgado, Rita; Drew, Michael G. B.; Félix, Vítor
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 13
• Pages of publication: 1316 - 1324
• a: 9.301 ± 0.003 Å
• b: 11.589 ± 0.003 Å
• c: 12.641 ± 0.003 Å
• α: 76.76 ± 0.02°
• β: 85.04 ± 0.02°
• γ: 77.46 ± 0.02°
• Cell volume: 1293.7 ± 0.6 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 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: 0.1575
• Residual factor for significantly intense reflections: 0.071
• Weighted residual factors for significantly intense reflections: 0.1595
• Weighted residual factors for all reflections included in the refinement: 0.1769
• Goodness-of-fit parameter for all reflections included in the refinement: 0.881
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No