Information card for entry 7044746

Structure parameters

• Formula: C26 H19 Cl2 N6 Ni O5
• Calculated formula: C26 H19 Cl2 N6 Ni O5
• Title of publication: A multifunctional Ni(II) coordination polymer: synthesis, crystal structure and applications as luminescence sensor, electrochemical probe, and photocatalyst
• Authors of publication: Cui, Jing-Wang; hou, Suo-Xia; Li, Yuehua; Cui, Guang Hua
• Journal of publication: Dalton Transactions
• Year of publication: 2017
• a: 11.5173 ± 0.0013 Å
• b: 14.2819 ± 0.0016 Å
• c: 15.8654 ± 0.0018 Å
• α: 90°
• β: 98.361 ± 0.002°
• γ: 90°
• Cell volume: 2581.9 ± 0.5 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: 0.0782
• Residual factor for significantly intense reflections: 0.0463
• Weighted residual factors for significantly intense reflections: 0.1043
• Weighted residual factors for all reflections included in the refinement: 0.1207
• Goodness-of-fit parameter for all reflections included in the refinement: 0.989
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No