Information card for entry 7044489

Structure parameters

• Formula: C48 H48 Cl6 Er2 O24
• Calculated formula: C48 H48 Cl6 Er2 O24
• SMILES: C(=O)(O[Er]12([O]=C(O[Er]3(OC(=[O]3)COc3ccc(cc3)Cl)(OC(=O)COc3ccc(cc3)Cl)([O]=C(O2)COc2ccc(cc2)Cl)([OH2])([OH2])[OH2])COc2ccc(cc2)Cl)([OH2])([OH2])(OC(=[O]1)COc1ccc(cc1)Cl)[OH2])COc1ccc(cc1)Cl
• Title of publication: Facile synthesis of highly biocompatible folic acid-functionalized SiO2 encapsulated rare-earth metal complexes nanoparticles and its application on targeted metal-based complex delivery
• Authors of publication: Xu, Xiu ling; Hu, Fan; Shuai, Qi
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 14.528 ± 0.003 Å
• b: 9.303 ± 0.002 Å
• c: 39.895 ± 0.007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5392 ± 1.9 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.1166
• Residual factor for significantly intense reflections: 0.0972
• Weighted residual factors for significantly intense reflections: 0.1981
• Weighted residual factors for all reflections included in the refinement: 0.2067
• Goodness-of-fit parameter for all reflections included in the refinement: 1.16
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No