Information card for entry 2243731

Structure parameters

• Chemical name: Bis{2-hydroxy-<i>N</i>'-[1-(pyrazin-2-yl)ethylidene]benzohydrazidato}cadmium(II)
• Formula: C26 H22 Cd N8 O4
• Calculated formula: C26 H22 Cd N8 O4
• SMILES: c1(c(O)cccc1)C1=N[N]2=C(c3[n](ccnc3)[Cd]342(O1)[N](=C(c1[n]3ccnc1)C)N=C(c1c(cccc1)O)O4)C
• Title of publication: Crystal structure of bis{2-hydroxy-<i>N</i>'-[1-(pyrazin-2-yl)ethylidene]benzohydrazidato}cadmium(II)
• Authors of publication: Yang, Ping; Xie, Xiao-Bao; Shi, Qing-Shan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2021
• Journal volume: 77
• Journal issue: 2
• Pages of publication: 153 - 157
• a: 12.6654 ± 0.0001 Å
• b: 17.6394 ± 0.00018 Å
• c: 10.888 ± 0.00011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2432.49 ± 0.04 ų
• Cell temperature: 108 ± 2 K
• Ambient diffraction temperature: 108 ± 2 K
• Number of distinct elements: 5
• Space group number: 41
• Hermann-Mauguin space group symbol: A e a 2
• Hall space group symbol: A 2 -2ab
• Residual factor for all reflections: 0.0258
• Residual factor for significantly intense reflections: 0.0257
• Weighted residual factors for significantly intense reflections: 0.0748
• Weighted residual factors for all reflections included in the refinement: 0.0749
• Goodness-of-fit parameter for all reflections included in the refinement: 1.201
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes