Information card for entry 1507922

Structure parameters

• Formula: C23 H32 Gd N7 O13
• Calculated formula: C23 H32 Gd N7 O13
• SMILES: [Gd]12345([O]=C(NCc6ncccc6)c6c([O]1CC(N(C(C)C)C(C)C)=[O]2)cccc6)(ON(=[O]3)=O)(ON(=[O]4)=O)([O]=N(=O)O5)[OH2].N#CC
• Title of publication: Synthesis, crystal structures and luminescence properties of lanthanide complexes with a tridentate salicylamide-type ligand
• Authors of publication: Guo, Yuan-Yuan; Lu, Zheng-Dan; Tang, Xiao-Liang; Dou, Wei; Qin, Wen-Wu; Wu, Jiang; Yang, Li-Zi; Zhang, Guo-Lin; Liu, Wei-Sheng; Ru, Jia-Xi
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2012
• Journal volume: 391
• Pages of publication: 182 - 188
• a: 11.77 ± 0.007 Å
• b: 17.687 ± 0.011 Å
• c: 15.781 ± 0.01 Å
• α: 90°
• β: 105.003 ± 0.008°
• γ: 90°
• Cell volume: 3173 ± 3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 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: 0.1103
• Residual factor for significantly intense reflections: 0.0501
• Weighted residual factors for significantly intense reflections: 0.1069
• Weighted residual factors for all reflections included in the refinement: 0.1483
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No