Information card for entry 4345986

Structure parameters

• Formula: C88 H56 Cl4 N12 O9 Zn4
• Calculated formula: C88 H56 Cl4 N12 O9 Zn4
• Title of publication: Syntheses, structures and luminescent properties of two new two-fold interpenetrating 2D coordination polymers based on 4′-(4-carboxyphenyl)-4,2′:6′,4″-terpyridine
• Authors of publication: Yuan, Fei; An, Ran; Hu, Huai-Ming; Shen, Sa-Sa; Wang, Xiaofang; Yang, Meng-Lin; Xue, Ganglin
• Journal of publication: Inorganic Chemistry Communications
• Year of publication: 2015
• Journal volume: 56
• Pages of publication: 1
• a: 15.379 ± 0.003 Å
• b: 12.637 ± 0.002 Å
• c: 21.406 ± 0.004 Å
• α: 90°
• β: 100.804 ± 0.004°
• γ: 90°
• Cell volume: 4086.4 ± 1.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• 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: 0.1596
• Residual factor for significantly intense reflections: 0.0867
• Weighted residual factors for significantly intense reflections: 0.2019
• Weighted residual factors for all reflections included in the refinement: 0.2466
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No