Information card for entry 7048363

Structure parameters

• Formula: C24 H26 Cl2 Cu2 N2 O11 S2
• Calculated formula: C24 H26 Cl2 Cu2 N2 O11 S2
• Title of publication: Thioether sulfur-bound [Cu₂] complexes showing catechol oxidase activity and DNA cleaving behaviour.
• Authors of publication: Das, Manisha; Afsan, Zeenat; Basak, Dipmalya; Arjmand, Farukh; Ray, Debashis
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 4
• Pages of publication: 1292 - 1313
• a: 8.566 ± 0.007 Å
• b: 12.777 ± 0.012 Å
• c: 13.867 ± 0.007 Å
• α: 99.18 ± 0.06°
• β: 91.21 ± 0.06°
• γ: 104.27 ± 0.08°
• Cell volume: 1449 ± 2 ų
• Cell temperature: 299 ± 2 K
• Ambient diffraction temperature: 299 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.118
• Residual factor for significantly intense reflections: 0.055
• Weighted residual factors for significantly intense reflections: 0.1297
• Weighted residual factors for all reflections included in the refinement: 0.1585
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No