Information card for entry 7229007

Structure parameters

• Formula: C53 H50 Co N6 O5
• Calculated formula: C53 H50 Co N6 O5
• SMILES: [Co]123(OC(=N[N]1=C(C)c1cc4c(cc1)cccc4)c1ccccc1)(OC(=N[N]2=C(C)c1cc2c(cc1)cccc2)c1ccccc1)[n]1cccc2c1c1[n]3cccc1cc2.OC.OC.OC
• Title of publication: Ni(ii) and Co(ii) complexes of an asymmetrical aroylhydrazone: synthesis, molecular structures, DNA binding, protein interaction, radical scavenging and cytotoxic activity
• Authors of publication: Li, Yueqin; Yang, Zhiwei; Zhou, Minya; Li, Yun; He, Jing; Wang, Xuehong; Lin, Zhengfeng
• Journal of publication: RSC Adv.
• Year of publication: 2017
• Journal volume: 7
• Journal issue: 66
• Pages of publication: 41527
• a: 10.36 ± 0.006 Å
• b: 15.843 ± 0.009 Å
• c: 28.627 ± 0.015 Å
• α: 90°
• β: 103.66 ± 0.018°
• γ: 90°
• Cell volume: 4566 ± 4 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 5
• 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: 0.1513
• Residual factor for significantly intense reflections: 0.0726
• Weighted residual factors for significantly intense reflections: 0.1862
• Weighted residual factors for all reflections included in the refinement: 0.2539
• Goodness-of-fit parameter for all reflections included in the refinement: 0.972
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No