Information card for entry 4100879

Structure parameters

• Formula: C32 H32 Cu2 O10 S2
• Calculated formula: C32 H32 Cu2 O10 S2
• SMILES: [Cu]1234([Cu](OC(c5ccccc5)=[O]1)(OC(c1ccccc1)=[O]2)(OC(c1ccccc1)=[O]3)(OC(c1ccccc1)=[O]4)[O]=S(C)C)[O]=S(C)C
• Title of publication: Magnetic Properties and Crystal Structure of a One-dimensional Phase of Tetrakis(μ~2~-benzoato-O,O'-bis(dimethylsulfoxide)-di-copper(II)
• Authors of publication: Reyes-Ortega, Yasmi; Alcántara-Flores, José L.; Hernández-Galindo, María C.; Ramírez-Rosales, Daniel; Bernès, Sylvain; Ramírez-García, Juán C.; Zamorano-Ulloa, Rafael; Escudero, Roberto
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• a: 12.0407 ± 0.0009 Å
• b: 17.0916 ± 0.0013 Å
• c: 17.268 ± 0.0015 Å
• α: 90°
• β: 103.062 ± 0.006°
• γ: 90°
• Cell volume: 3461.7 ± 0.5 ų
• Cell temperature: 296 ± 1 K
• Ambient diffraction temperature: 296 ± 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
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No