Information card for entry 7251312

Structure parameters

• Formula: C13 H15 N3 O5
• Calculated formula: C13 H15 N3 O5
• Title of publication: Water-soluble binuclear aquo Cu(ii) complex with an amide ligand as an electrocatalyst for the OER, HER and CO2RR
• Authors of publication: Khan, Md. Adnan; Shruti, Sonal; Sengupta, Swaraj; Khan, Sahanwaj; Bhardwaj, Prabhakar; Kumar, Pankaj; Naskar, Subhendu
• Journal of publication: RSC Advances
• Year of publication: 2025
• Journal volume: 15
• Journal issue: 54
• Pages of publication: 46425 - 46433
• a: 8.3624 ± 0.0006 Å
• b: 8.5232 ± 0.0008 Å
• c: 9.6931 ± 0.0008 Å
• α: 92.749 ± 0.007°
• β: 92.29 ± 0.006°
• γ: 96.721 ± 0.007°
• Cell volume: 684.61 ± 0.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 298.15 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0654
• Residual factor for significantly intense reflections: 0.0461
• Weighted residual factors for significantly intense reflections: 0.1162
• Weighted residual factors for all reflections included in the refinement: 0.1333
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No