Information card for entry 7034656

Structure parameters

• Formula: C24 H40 Cl2 Cu N8 O8
• Calculated formula: C24 H40 Cl2 Cu N8 O8
• Title of publication: Correlation between the molecular structure and the kinetics of decomposition of azamacrocyclic copper(ii) complexes.
• Authors of publication: Acosta-Rueda, Laura; Delgado-Pinar, Estefanía; Pitarch-Jarque, Javier; Rodríguez, Alexis; Blasco, Salvador; González, Jorge; Basallote, Manuel G.; García-España, Enrique
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 17
• Pages of publication: 8255 - 8266
• a: 10.747 ± 0.0002 Å
• b: 14.267 ± 0.0003 Å
• c: 20.317 ± 0.0004 Å
• α: 90°
• β: 94.305 ± 0.001°
• γ: 90°
• Cell volume: 3106.36 ± 0.11 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0738
• Residual factor for significantly intense reflections: 0.054
• Weighted residual factors for significantly intense reflections: 0.1461
• Weighted residual factors for all reflections included in the refinement: 0.162
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No