Information card for entry 1551867

Structure parameters

• Formula: C24 H20 Cu2 N4 O11
• Calculated formula: C24 H20 Cu2 N4 O11
• SMILES: C1(=O)c2cccc3C(=O)O[Cu]([n]23)([n]2ccc(cc2)c2cc[n](cc2)[Cu]23([n]4c(C(=O)O2)cccc4C(=O)O3)[OH2])(O1)[OH2].O
• Title of publication: Copper Coordination Polymer Electrocatalyst for Strong Hydrogen Evolution Reaction Activity in Neutral Medium: Influence of Coordination Environment and Network Structure
• Authors of publication: Muthukumar, P.; Moon, Dohyun; Anthony, Philip Philip
• Journal of publication: Catalysis Science & Technology
• Year of publication: 2019
• a: 14.695 ± 0.003 Å
• b: 5.165 ± 0.001 Å
• c: 31.873 ± 0.006 Å
• α: 90°
• β: 94.29 ± 0.03°
• γ: 90°
• Cell volume: 2412.4 ± 0.8 ų
• Cell temperature: 220 ± 2 K
• Ambient diffraction temperature: 220 ± 2 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: 0.0387
• Residual factor for significantly intense reflections: 0.0336
• Weighted residual factors for significantly intense reflections: 0.091
• Weighted residual factors for all reflections included in the refinement: 0.0932
• Goodness-of-fit parameter for all reflections included in the refinement: 1.082
• Diffraction radiation wavelength: 0.63 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No