Information card for entry 4331071

Structure parameters

• Formula: C23 H28 Cl7 Cu3 N9 O2
• Calculated formula: C23 H28 Cl7 Cu3 N9 O2
• Title of publication: Infinite Copper(II) Coordination Architectures from a Resonative Aminotriazine-Derived Tripodal Ligand: Synthesis, Structures, and Magnetic Properties
• Authors of publication: Meng-Jung Tsai; Jing-Yun Wu; Ming-Hsi Chiang; Cheng-Hao Huang; Ming-Yu Kuo; Long-Li Lai
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 12360 - 12371
• a: 7.5069 ± 0.0004 Å
• b: 12.5901 ± 0.0007 Å
• c: 16.6286 ± 0.0009 Å
• α: 88.738 ± 0.003°
• β: 84.968 ± 0.004°
• γ: 85.381 ± 0.003°
• Cell volume: 1560.29 ± 0.15 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.1215
• Residual factor for significantly intense reflections: 0.062
• Weighted residual factors for significantly intense reflections: 0.1476
• Weighted residual factors for all reflections included in the refinement: 0.1862
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No