Information card for entry 7053582

Structure parameters

• Formula: C19 H20 Cu Mn N4 O10
• Calculated formula: C19 H20 Cu Mn N4 O10
• SMILES: C[O]1c2c3c(C=[N]4CCC[N]5=Cc6cccc7c6[O]6[Mn]81([O]3[Cu]456)([O]7C)(ON(=O)=O)ON(=[O]8)=O)ccc2
• Title of publication: New heterometallic coordination polymers constructed from 3d‒3d′ binuclear nodes
• Authors of publication: Branzea, Diana G.; Madalan, Augustin M.; Ciattini, Samuele; Avarvari, Narcis; Caneschi, Andrea; Andruh, Marius
• Journal of publication: New Journal of Chemistry
• Year of publication: 2010
• Journal volume: 34
• Journal issue: 11
• Pages of publication: 2479
• a: 8.6001 ± 0.001 Å
• b: 11.2045 ± 0.0015 Å
• c: 11.3972 ± 0.0013 Å
• α: 83.875 ± 0.01°
• β: 84.626 ± 0.009°
• γ: 84.262 ± 0.01°
• Cell volume: 1082.7 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.09
• Residual factor for significantly intense reflections: 0.0565
• Weighted residual factors for significantly intense reflections: 0.1066
• Weighted residual factors for all reflections included in the refinement: 0.1174
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No