Information card for entry 7004887

Structure parameters

• Formula: C32 H80 Cl8 Co2 Cu4 N8 O8 Pb2
• Calculated formula: C32 H80 Cl8 Co2 Cu4 N8 O8 Pb2
• SMILES: C1C[N](C)(C)[Pb]([O]1[Cu]123[N](CC[O]1[Co]14([N](CC[O]24[Cu]2([N](CC[O]12)(C)C)(Cl)[Cl]3)(C)C)Cl)(C)C)Cl
• 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: 19.738 ± 0.001 Å
• b: 10.9365 ± 0.0009 Å
• c: 13.908 ± 0.002 Å
• α: 90°
• β: 97.549 ± 0.002°
• γ: 90°
• Cell volume: 2976.2 ± 0.5 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: 0.051
• Residual factor for significantly intense reflections: 0.04
• Weighted residual factors for significantly intense reflections: 0.081
• Weighted residual factors for all reflections included in the refinement: 0.111
• Goodness-of-fit parameter for significantly intense reflections: 0.92
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No