Information card for entry 7719829

Structure parameters

• Formula: C40 H40 Br2 N4 O8 Zn
• Calculated formula: C40 H40 Br2 N4 O8 Zn
• Title of publication: Induction of helical chirality in tetrahedral transition metal complexes with non-bridging monodentate oxazolines.
• Authors of publication: Bakija, Marija; Perić, Berislav; Rinkovec, Tamara; Sanders, Ernest; Kokan, Zoran; Štefanić, Zoran; Vianello, Robert; Kirin, Srećko I
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2025
• Journal volume: 54
• Journal issue: 46
• Pages of publication: 17083 - 17101
• a: 13.3934 ± 0.0002 Å
• b: 16.74 ± 0.0003 Å
• c: 17.6341 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3953.66 ± 0.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0374
• Residual factor for significantly intense reflections: 0.0315
• Weighted residual factors for significantly intense reflections: 0.0763
• Weighted residual factors for all reflections included in the refinement: 0.0795
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No