Information card for entry 7037525

Structure parameters

• Formula: C24 H18 Cu N8 O2
• Calculated formula: C24 H18 Cu N8 O2
• SMILES: N(=N#N)[Cu]([n]1ccc(cc1)C(=O)c1ccccc1)([n]1ccc(cc1)C(=O)c1ccccc1)N=N#N
• Title of publication: Structural and magnetic modulations of copper(ii) azido complexes: unexpected in situ reactions of mono-N-donor pyridine-based co-ligands.
• Authors of publication: Zhao, Jiong-Peng; Xie, Yabo; Li, Jian-Rong; Bu, Xian-He
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 4
• Pages of publication: 1514 - 1524
• a: 3.8316 ± 0.0008 Å
• b: 8.6029 ± 0.0017 Å
• c: 16.855 ± 0.003 Å
• α: 94.24 ± 0.03°
• β: 96.16 ± 0.03°
• γ: 99.46 ± 0.03°
• Cell volume: 542.5 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0973
• Residual factor for significantly intense reflections: 0.0657
• Weighted residual factors for significantly intense reflections: 0.1515
• Weighted residual factors for all reflections included in the refinement: 0.1664
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No