Information card for entry 7703732

Structure parameters

• Formula: C73 H61 Dy5 N16 O24
• Calculated formula: C73 H61 Dy5 N16 O24
• SMILES: [Dy]1234567([O]8[Dy]9%10%11%12%13([OH2])[O]%14[Dy]%15%16%17%18%19%20[O]1=C([O]4[Dy]14%21([O]2C(=N[N]%21=Cc2c(O1)cccc2)c1[n]7c2c(c7nccnc7c7c2[n]6c(C([O]5%16)=N[N]%19=Cc2c(O%18)cccc2)cc7)cc1)([O]=C(O%11)C)(OC(=[O][Dy]128(O3)([O]9C(=N[N]2=Cc2c(O1)cccc2)c1[n]%13c2c3[n]%12c(C%14=N[N]%20=Cc5c(O%17)cccc5)ccc3c3nccnc3c2cc1)[O]=C([O]%10%15)C)C)OC(=[O]4)C)C)[OH]C.OC.OC
• Title of publication: Mitochondria-localizing dicarbohydrazide Ln complexes and their mechanism of in vitro anticancer activity.
• Authors of publication: Meng, Ting; Liu, Tong; Qin, Qi-Pin; Chen, Zi-Lu; Zou, Hua-Hong; Wang, Kai; Liang, Fu-Pei
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 14
• Pages of publication: 4404 - 4415
• a: 15.3966 ± 0.0008 Å
• b: 17.1849 ± 0.0009 Å
• c: 20.4428 ± 0.001 Å
• α: 111.135 ± 0.002°
• β: 90.178 ± 0.002°
• γ: 101.146 ± 0.002°
• Cell volume: 4934.2 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150.01 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: 0.1237
• Residual factor for significantly intense reflections: 0.0668
• Weighted residual factors for significantly intense reflections: 0.1562
• Weighted residual factors for all reflections included in the refinement: 0.2054
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No