Information card for entry 7043929

Structure parameters

• Formula: C39 H26 Cr N6 O12 Zn
• Calculated formula: C41 H26 Cr N6 O12 Zn
• Title of publication: Influence of the metal centres on the exchange interaction in heterometallic complexes with oxalate-bridged cations
• Authors of publication: Androš Dubraja, Lidija; Juric, Marijana; Torić, Filip; Pajić, Damir
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 11.415 ± 0.005 Å
• b: 13.771 ± 0.005 Å
• c: 13.822 ± 0.005 Å
• α: 64.436 ± 0.005°
• β: 84.222 ± 0.005°
• γ: 81.314 ± 0.005°
• Cell volume: 1936 ± 1.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0606
• Residual factor for significantly intense reflections: 0.0576
• Weighted residual factors for significantly intense reflections: 0.1699
• Weighted residual factors for all reflections included in the refinement: 0.1776
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54179 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No