Information card for entry 4315036

Structure parameters

• Formula: C130 H128 Eu2 N6 O18 S2
• Calculated formula: C126 H108 Eu2 N6 O16
• SMILES: N(c1ccc(C2=[O][Eu]345(OC(=[O]4)c4ccc(N(Cc6ccccc6)Cc6ccccc6)cc4)([OH2])(OC(=[O]3)c3ccc(cc3)N(Cc3ccccc3)Cc3ccccc3)([O]3C(=[O][Eu]463(OC(=[O]4)c3ccc(cc3)N(Cc3ccccc3)Cc3ccccc3)(OC(=[O]6)c3ccc(N(Cc4ccccc4)Cc4ccccc4)cc3)([OH2])([O]25)[OH2])c2ccc(N(Cc3ccccc3)Cc3ccccc3)cc2)[OH2])cc1)(Cc1ccccc1)Cc1ccccc1
• Title of publication: Synthesis, Crystal Structure, and Photoluminescence of Homodinuclear Lanthanide 4-(Dibenzylamino)benzoate Complexes
• Authors of publication: A. R. Ramya; M. L. P. Reddy; Alan H. Cowley; Kalyan V. Vasudevan
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 2407 - 2415
• a: 9.879 ± 0.005 Å
• b: 17.259 ± 0.005 Å
• c: 17.896 ± 0.005 Å
• α: 85.264 ± 0.005°
• β: 83.206 ± 0.005°
• γ: 88.609 ± 0.005°
• Cell volume: 3019 ± 2 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0997
• Residual factor for significantly intense reflections: 0.0521
• Weighted residual factors for significantly intense reflections: 0.1096
• Weighted residual factors for all reflections included in the refinement: 0.1246
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No