Information card for entry 4321441

Structure parameters

• Formula: C35 H64 F9 La N8 O17 S3
• Calculated formula: C35 H64 F9 La N8 O17 S3
• SMILES: [La]1234([O]=C(N(C)C)CCC(=[O]1)N(C)C)([O]=C(N(C)C)CCC(=[O]2)N(C)C)([O]=C(N(C)C)CCC(=[O]3)N(C)C)[O]=C(N(C)C)CCC(=[O]4)N(C)C.S(=O)(=O)([O-])C(F)(F)F.S(=O)(=O)([O-])C(F)(F)F.S(=O)(=O)([O-])C(F)(F)F
• Title of publication: Coordination of Lanthanide Triflates and Perchlorates with N,N,N',N'-Tetramethylsuccinamide
• Authors of publication: Brian M. Rapko; Bruce K. McNamara; Robin D. Rogers; Grant A. Broker; Gregg J. Lumetta; Benjamin P. Hay
• Journal of publication: Inorganic Chemistry
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 4858 - 4867
• a: 11.0952 ± 0.0002 Å
• b: 19.2672 ± 0.0002 Å
• c: 24.9759 ± 0.0003 Å
• α: 90°
• β: 90.637 ± 0.001°
• γ: 90°
• Cell volume: 5338.85 ± 0.13 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0625
• Residual factor for significantly intense reflections: 0.0428
• Weighted residual factors for all reflections: 0.107
• Weighted residual factors for significantly intense reflections: 0.0901
• Goodness-of-fit parameter for all reflections: 1.056
• Goodness-of-fit parameter for significantly intense reflections: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No