Information card for entry 4507916

Structure parameters

• Formula: C24 H44 Gd2 N2 O26
• Calculated formula: C24 H44 Gd2 N2 O26
• SMILES: c12ccc(cc1)OCC(=O)O[Gd]1(OC(=O)CN(c3ccc(cc3)OCC(=O)O[Gd]3(OC(=O)CN2CC(=O)O3)([OH2])([OH2])([OH2])([OH2])[OH2])CC(=O)O1)([OH2])([OH2])([OH2])([OH2])[OH2].O.O
• Title of publication: Two Series of Luminescent Flexible Polycarboxylate Lanthanide Coordination Complexes with Double Layer and Rectangle Metallomacrocycle Structures
• Authors of publication: Hou, Guang-Feng; Li, Hong-Xing; Li, Wei-Zuo; Yan, Peng-Fei; Su, Xiao-Hong; Li, Guang-Ming
• Journal of publication: Crystal Growth & Design
• Year of publication: 2013
• Journal volume: 13
• Journal issue: 8
• Pages of publication: 3374
• a: 29.7113 ± 0.0008 Å
• b: 8.7956 ± 0.0002 Å
• c: 14.6009 ± 0.0004 Å
• α: 90°
• β: 111.409 ± 0.003°
• γ: 90°
• Cell volume: 3552.35 ± 0.17 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0411
• Residual factor for significantly intense reflections: 0.0259
• Weighted residual factors for significantly intense reflections: 0.0465
• Weighted residual factors for all reflections included in the refinement: 0.0539
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No