Information card for entry 7240757

Structure parameters

• Chemical name: HAN 10
• Formula: C39 H37 Cd2 N13 O21
• Calculated formula: C39 H37 Cd2 N13 O20
• SMILES: [Cd]12345[O]=C(N[N]2=Cc2c(O5)ccc(c2)N(=O)=O)CCC2N[N]5[Cd]67([N](NC(=[O]6)CCC(=[O]1)N[N]3=Cc1c(O4)ccc(c1)N(=O)=O)=Cc1cc(ccc1O7)N(=O)=O)(Oc1c(cc(N(=O)=O)cc1)C=5)[O]=2.N(C)(C=O)C.O.O.O
• Title of publication: Synthesis, crystal structures, and luminescent properties of Zn(ii), Cd(ii), Eu(iii) complexes and detection of Fe(iii) ions based on a diacylhydrazone Schiff base
• Authors of publication: Han, Aiying; Su, Hao; Xu, Guohong; Khan, Maroof Ahmad; Li, Hui
• Journal of publication: RSC Advances
• Year of publication: 2020
• Journal volume: 10
• Journal issue: 39
• Pages of publication: 23372 - 23378
• a: 12.091 ± 0.002 Å
• b: 12.459 ± 0.003 Å
• c: 17.13 ± 0.003 Å
• α: 90.42 ± 0.03°
• β: 104.13 ± 0.03°
• γ: 95.41 ± 0.03°
• Cell volume: 2490 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.071
• Residual factor for significantly intense reflections: 0.0575
• Weighted residual factors for significantly intense reflections: 0.1631
• Weighted residual factors for all reflections included in the refinement: 0.175
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No