Information card for entry 7707000

Structure parameters

• Formula: C21 H16 Cl2 N3 O3 Sm
• Calculated formula: C21 H16 Cl2 N3 O3 Sm
• SMILES: [Sm]12(Cl)(Cl)([O]=n3c4c(O1)cccc4ccc3)([OH2])[n]1cccc3c1c1[n]2cccc1cc3
• Title of publication: High anticancer activity and apoptosis- and autophagy-inducing properties of novel lanthanide(III) complexes bearing 8-hydroxyquinoline-<i>N</i>-oxide and 1,10-phenanthroline.
• Authors of publication: Yang, Yan; Zhou, Zhen; Wei, Zu-Zhuang; Qin, Qi-Pin; Yang, Lin; Liang, Hong
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 17
• Pages of publication: 5828 - 5834
• a: 9.9116 ± 0.0003 Å
• b: 11.0963 ± 0.0003 Å
• c: 18.2882 ± 0.0005 Å
• α: 90°
• β: 92.574 ± 0.002°
• γ: 90°
• Cell volume: 2009.35 ± 0.1 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: 0.0564
• Residual factor for significantly intense reflections: 0.0372
• Weighted residual factors for significantly intense reflections: 0.0689
• Weighted residual factors for all reflections included in the refinement: 0.0781
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No