Information card for entry 7031122

Structure parameters

• Formula: C30 H38 Cu2 N6 O4
• Calculated formula: C30 H38 Cu2 N6 O4
• SMILES: [Cu]123Oc4ccccc4C=[N]1C(C)(C)C[N]2=C(C)C(=N3=O)C
• Title of publication: Antiferromagnetic Cu-Gd interactions through an oxime bridge.
• Authors of publication: Costes, Jean-Pierre; Duhayon, Carine; Mallet-Ladeira, Sonia; Vendier, Laure; Garcia-Tojal, Javier; Banet, Luisa Lopez
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 29
• Pages of publication: 11388 - 11396
• a: 7.6254 ± 0.0008 Å
• b: 9.6654 ± 0.001 Å
• c: 10.4451 ± 0.0012 Å
• α: 90.651 ± 0.009°
• β: 108.055 ± 0.01°
• γ: 100.708 ± 0.009°
• Cell volume: 717.22 ± 0.14 ų
• Cell temperature: 180 K
• Ambient diffraction temperature: 180 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: 0.0947
• Residual factor for significantly intense reflections: 0.0607
• Weighted residual factors for all reflections: 0.0826
• Weighted residual factors for significantly intense reflections: 0.0644
• Weighted residual factors for all reflections included in the refinement: 0.0578
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0225
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No