Information card for entry 2312038

Structure parameters

• Chemical name: [μ-6,11-Dimethyl-7,10-diazahexadeca-5,11-diene-2,4,13,15-tetraolato(4-)-1κ^4^<i>O</i>^2^,<i>O</i>^4^,<i>O</i>^13^,<i>O</i>^15^:2κ^4^<i>N</i>^7^,<i>N</i>^10^,<i>O</i>^4^,<i>O</i>^13^](pyridine-1κ<i>N</i>)dicopper(II)
• Formula: C21 H25 Cu2 N3 O4
• Calculated formula: C21 H25 Cu2 N3 O4
• SMILES: [Cu]123([n]4ccccc4)OC(=CC4[O]1[Cu]15[N](=C(C=4)C)CC[N]1=C(C=C([O]25)C=C(O3)C)C)C
• Title of publication: Effects of electron-donating ability of binding sites on coordination number: the interactions of a cyclic Schiff base with copper ions.
• Authors of publication: Ranaweera, Samantha A.; Donnadieu, Bruno; Henry, William P.; White, Mark G.
• Journal of publication: Acta crystallographica. Section C, Structural chemistry
• Year of publication: 2023
• Journal volume: 79
• Journal issue: Pt 4
• Pages of publication: 142 - 148
• a: 8.0549 ± 0.0005 Å
• b: 9.8811 ± 0.0006 Å
• c: 13.7189 ± 0.0008 Å
• α: 106.451 ± 0.001°
• β: 103.271 ± 0.001°
• γ: 91.482 ± 0.001°
• Cell volume: 1014.4 ± 0.11 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0233
• Residual factor for significantly intense reflections: 0.0205
• Weighted residual factors for significantly intense reflections: 0.054
• Weighted residual factors for all reflections included in the refinement: 0.0554
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes