Information card for entry 1572949

Structure parameters

• Chemical name: Bis(triethylammonium) {2,2'-[1,4-phenylenebis(nitrilomethylidyne)]diphenolato}bis[dichloridozinc(II)]
• Formula: C32 H46 Cl4 N4 O2 Zn2
• Calculated formula: C32 H46 Cl4 N4 O2 Zn2
• Title of publication: Crystal structures and photophysical properties of mono- and dinuclear ZnII complexes flanked by triethylammonium
• Authors of publication: Le Thi Hong, Hai; Nguyen, Hien; Trinh Hong, Duong; Nguyen Hoang, Ninh; Nguyen Nhat, Khanh; Van Meervelt, Luc
• Journal of publication: Acta Crystallographica Section E Crystallographic Communications
• Year of publication: 2024
• Journal volume: 80
• Journal issue: 11
• Pages of publication: 1210 - 1216
• a: 11.9843 ± 0.0009 Å
• b: 13.457 ± 0.0007 Å
• c: 11.9944 ± 0.0011 Å
• α: 90°
• β: 103.838 ± 0.009°
• γ: 90°
• Cell volume: 1878.2 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0743
• Residual factor for significantly intense reflections: 0.0525
• Weighted residual factors for significantly intense reflections: 0.1389
• Weighted residual factors for all reflections included in the refinement: 0.1575
• Goodness-of-fit parameter for all reflections included in the refinement: 1.053
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No