Information card for entry 7032582

Structure parameters

• Formula: C48 H42 Cu2 N16 O15
• Calculated formula: C48 H42 Cu2 N16 O15
• Title of publication: Discrete and polymeric Cu(ii) complexes featuring substituted indazole ligands: their synthesis and structural chemistry.
• Authors of publication: Hawes, Chris S.; Kruger, Paul E.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 43
• Pages of publication: 16450 - 16458
• a: 7.2872 ± 0.0002 Å
• b: 15.9102 ± 0.0005 Å
• c: 21.2623 ± 0.0006 Å
• α: 90°
• β: 99.328 ± 0.003°
• γ: 90°
• Cell volume: 2432.57 ± 0.12 ų
• Cell temperature: 120.01 ± 0.1 K
• Ambient diffraction temperature: 120.01 ± 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: 0.0744
• Residual factor for significantly intense reflections: 0.0554
• Weighted residual factors for significantly intense reflections: 0.1387
• Weighted residual factors for all reflections included in the refinement: 0.1536
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No