Information card for entry 7034831

Structure parameters

• Formula: C22 H24 Cu Dy N5 O13
• Calculated formula: C22 H24 Cu Dy N5 O13
• SMILES: [Dy]123456([O](c7c8[O]1[Cu]19[O]2c2c([O]3C)cccc2C=[N]9[C@H]2[C@H]([N]1=Cc8ccc7)CCCC2)C)(ON(=[O]4)=O)(ON(=O)=[O]5)[O]=N(=O)O6
• Title of publication: Temperature-controlled polymorphism of chiral Cu(II)-Ln(III) dinuclear complexes exhibiting slow magnetic relaxation.
• Authors of publication: Wen, He-Rui; Bao, Jun; Liu, Sui-Jun; Liu, Cai-Ming; Zhang, Cai-Wei; Tang, Yun-Zhi
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 24
• Pages of publication: 11191 - 11201
• a: 9.2947 ± 0.0002 Å
• b: 12.0714 ± 0.0003 Å
• c: 12.1819 ± 0.0003 Å
• α: 101.564 ± 0.001°
• β: 95.715 ± 0.001°
• γ: 90.508 ± 0.001°
• Cell volume: 1331.83 ± 0.05 ų
• Cell temperature: 138 ± 2 K
• Ambient diffraction temperature: 138 K
• Number of distinct elements: 6
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.0211
• Residual factor for significantly intense reflections: 0.0189
• Weighted residual factors for significantly intense reflections: 0.0426
• Weighted residual factors for all reflections included in the refinement: 0.044
• Goodness-of-fit parameter for all reflections included in the refinement: 1.143
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No