Information card for entry 7222146

Structure parameters

• Formula: C28 H42 Cu2 N10 O18
• Calculated formula: C28 H42 Cu2 N10 O18
• SMILES: c12O[Cu]3([N](=Cc1cccc2OC)CC[N]13CC[NH2+]CC1)(ON(=O)=O)[O]=N(=O)[O][Cu]12(Oc3c(cccc3OC)C=[N]1CC[N]12CC[NH2+]CC1)ON(=O)=O.N(=O)(=O)[O-].O.O
• Title of publication: A family of ligand and anion dependent structurally diverse Cu(II) Schiff-base complexes and their catalytic efficacy in O-arylation reaction in ethanolic medium
• Authors of publication: Maity, Tanmoy; Saha, Debraj; Bhunia, Susmita; Brandao, Paula; Das, Soma; Koner, Subratanath
• Journal of publication: RSC Adv.
• Year of publication: 2015
• a: 15.3483 ± 0.0009 Å
• b: 12.7358 ± 0.0008 Å
• c: 19.076 ± 0.0011 Å
• α: 90°
• β: 92.446 ± 0.004°
• γ: 90°
• Cell volume: 3725.4 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.1406
• Residual factor for significantly intense reflections: 0.0756
• Weighted residual factors for significantly intense reflections: 0.1962
• Weighted residual factors for all reflections included in the refinement: 0.247
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No