Information card for entry 4337783

Structure parameters

• Formula: C26 H30 Cu N6 O10 S
• Calculated formula: C26 H30 Cu N6 O10 S
• Title of publication: Cooperative Anion Recognition in Copper(II) and Zinc(II) Complexes with a Ditopic Tripodal Ligand Containing a Urea Group.
• Authors of publication: Carreira-Barral, Israel; Rodríguez-Blas, Teresa; Platas-Iglesias, Carlos; de Blas, Andrés; Esteban-Gómez, David
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 5
• Pages of publication: 2554 - 2568
• a: 8.7439 ± 0.0005 Å
• b: 12.9521 ± 0.0007 Å
• c: 14.6569 ± 0.0008 Å
• α: 65.471 ± 0.002°
• β: 89.183 ± 0.003°
• γ: 70.88 ± 0.003°
• Cell volume: 1412.43 ± 0.14 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0263
• Residual factor for significantly intense reflections: 0.0247
• Weighted residual factors for significantly intense reflections: 0.0661
• Weighted residual factors for all reflections included in the refinement: 0.0672
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No