Information card for entry 7004888

Structure parameters

• Formula: C18 H48 Cd2 Cl6 Co Cu2 N4 O6
• Calculated formula: C18 H48 Cd2 Cl6 Co Cu2 N4 O6
• SMILES: C1C[N](C)(C)[Cu]234[N](C)(CC[O]3[Co]3([O]12[Cd]([OH]C)(Cl)([Cl]4)Cl)[O]12CC[N](C)(C)[Cu]452([N](CC[O]34)(C)C)[Cd]1([OH]C)(Cl)([Cl]5)Cl)C
• Title of publication: Self-assembly of the unique heterotrimetallic Cu/Co/M complexes possessing triangular antiferromagnetic {Cu2CoPb}2 and linear ferromagnetic {Cu2CoCd2} cores.
• Authors of publication: Nesterov, Dmytro S.; Kokozay, Volodymyr N.; Skelton, Brian W.; Jezierska, Julia; Ozarowski, Andrew
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 5
• Pages of publication: 558 - 564
• a: 8.125 ± 0.003 Å
• b: 20.612 ± 0.008 Å
• c: 11.551 ± 0.004 Å
• α: 90°
• β: 109.099 ± 0.007°
• γ: 90°
• Cell volume: 1828 ± 1.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 8
• 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: 0.112
• Residual factor for significantly intense reflections: 0.073
• Weighted residual factors for all reflections included in the refinement: 0.19
• Goodness-of-fit parameter for significantly intense reflections: 1.228
• Goodness-of-fit parameter for all reflections included in the refinement: 1.204
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No