Information card for entry 7046726

Structure parameters

• Formula: C22 H40 Cu2 N4 O6
• Calculated formula: C22 H40 Cu2 N4 O6
• SMILES: CC1=CC(=[N]2CC[N](C)(C)[Cu]32(O1)[O](C(=O)C)[Cu]12([N](=C(C=C(O2)C)C)CC[N]1(C)C)[O]3C(=O)C)C
• Title of publication: β-Ketoiminato-based copper(ii) complexes as CVD precursors for copper and copper oxide layer formation.
• Authors of publication: Pousaneh, Elaheh; Korb, Marcus; Dzhagan, Volodymyr; Weber, Marcus; Noll, Julian; Mehring, Michael; Zahn, Dietrich R. T.; Schulz, Stefan E.; Lang, Heinrich
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2018
• Journal volume: 47
• Journal issue: 30
• Pages of publication: 10002 - 10016
• a: 11.0854 ± 0.001 Å
• b: 10.0289 ± 0.0005 Å
• c: 11.5267 ± 0.001 Å
• α: 90°
• β: 99.229 ± 0.008°
• γ: 90°
• Cell volume: 1264.89 ± 0.17 ų
• Cell temperature: 115 ± 0.1 K
• Ambient diffraction temperature: 115 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0525
• Residual factor for significantly intense reflections: 0.0367
• Weighted residual factors for significantly intense reflections: 0.0869
• Weighted residual factors for all reflections included in the refinement: 0.0943
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No