Information card for entry 7209824

Structure parameters

• Formula: C18 H19 Cl2 Cu N5 O
• Calculated formula: C18 H19 Cl2 Cu N5 O
• SMILES: [Cu]1(Cl)(Cl)([O]=CN(C)C)[n]2n(c3c(c2)cccc3)Cn2[n]1cc1ccccc21
• Title of publication: Group 11 complexes with the bidentate di(1H-indazol-1-yl)methane and di(2H-indazol-2-yl)methane) ligands
• Authors of publication: Pettinari, Claudio; Marchetti, Fabio; Orbisaglia, Serena; Pettinari, Riccardo; Ngoune, Jean; Gómez, Margarita; Santos, Carina; Álvarez, Eleuterio
• Journal of publication: CrystEngComm
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 19
• Pages of publication: 3892
• a: 9.4972 ± 0.0004 Å
• b: 18.641 ± 0.0007 Å
• c: 21.2437 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3760.9 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0315
• Residual factor for significantly intense reflections: 0.0266
• Weighted residual factors for significantly intense reflections: 0.0688
• Weighted residual factors for all reflections included in the refinement: 0.071
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No