Information card for entry 7245655

Structure parameters

• Common name: {[Cu2(DAP)4(NIP)2]?DMF]}n
• Formula: C47 H53 Cu2 N11 O13
• Calculated formula: C47 H53 Cu2 N11 O13
• Title of publication: Two multifunctional Cu(II) coordination complexes with mixed ligands as efficient catalysts for oxygen evolution reaction and photocatalytic degradation of methyl orange azo dyes
• Authors of publication: Li, Yanghua; Liu, Yuqi; Dai, Siyu; Jin, Nanhao; Wang, Xinying; Chen, Han; Liu, Xiaoming; Zhao, Yue; Luo, Huilong; Li, Wei
• Journal of publication: CrystEngComm
• Year of publication: 2022
• a: 26.8482 ± 0.0018 Å
• b: 10.3399 ± 0.0007 Å
• c: 22.165 ± 0.002 Å
• α: 90°
• β: 125.809 ± 0.001°
• γ: 90°
• Cell volume: 4990.1 ± 0.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0704
• Residual factor for significantly intense reflections: 0.048
• Weighted residual factors for significantly intense reflections: 0.1269
• Weighted residual factors for all reflections included in the refinement: 0.1467
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No