Information card for entry 7041574

Structure parameters

• Formula: C24 H16 Cu N6 O10
• Calculated formula: C24 H16 Cu N6 O10
• SMILES: C1(=O)c2cccc3c2c(C2N1[NH2][Cu]1([O]=2)([NH2]N2C(=O)c4cccc5cccc(c45)C2=[O]1)(ON(=O)=O)ON(=O)=O)ccc3
• Title of publication: Syntheses, crystal structures and photophysical properties of Cu(ii) complexes: fine tuning of a coordination sphere for selective binding of azamethiphos.
• Authors of publication: Raj, Pushap; Singh, Amanpreet; Singh, Ajnesh; Singh, Narinder
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• Journal volume: 46
• Journal issue: 3
• Pages of publication: 985 - 994
• a: 7.3858 ± 0.0004 Å
• b: 7.9511 ± 0.0004 Å
• c: 9.9894 ± 0.0005 Å
• α: 75.7 ± 0.002°
• β: 78.644 ± 0.002°
• γ: 84.546 ± 0.002°
• Cell volume: 556.66 ± 0.05 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: 0.0557
• Residual factor for significantly intense reflections: 0.0386
• Weighted residual factors for significantly intense reflections: 0.0814
• Weighted residual factors for all reflections included in the refinement: 0.0871
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No