Information card for entry 7054771

Structure parameters

• Chemical name: complex 1
• Formula: C55 H68 N16 O15 Zn2
• Calculated formula: C55 H68 N16 O15 Zn2
• Title of publication: Triazine -polycarboxylate acids complexes: synthesis, structure and photocatalytic activity
• Authors of publication: Wang, Zhi Nan; Wang, Xuan; Wei, Si-Yue; Wang, Jixiao; Bai, Feng Ying; Xing, Yong Heng; Sun, Lixian
• Journal of publication: New J. Chem.
• Year of publication: 2015
• a: 13.3096 ± 0.0007 Å
• b: 14.3661 ± 0.0007 Å
• c: 20.6457 ± 0.0008 Å
• α: 90°
• β: 126.685 ± 0.002°
• γ: 90°
• Cell volume: 3165.7 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.084
• Residual factor for significantly intense reflections: 0.0545
• Weighted residual factors for significantly intense reflections: 0.1689
• Weighted residual factors for all reflections included in the refinement: 0.1937
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No