Information card for entry 7009556

Structure parameters

• Common name: polynuclear carbonyl derivative Cu4(CCl3COO)6(CHCl2COOH)(CO)2
• Formula: C16 H2 Cl20 Cu4 O16
• Calculated formula: C16 H2 Cl20 Cu4 O16
• Title of publication: Synproportionation reactions between copper(II) trihalogenoacetates Cu(CX3CO2)2, X = F, Cl or Br, and copper in the presence of carbon monoxide
• Authors of publication: Daniela Belli Dell'Amico; Rocco Alessio; Fausto Calderazzo; Fabrizio Della Pina; Ulli Englert; Guido Pampaloni; Vincenzo Passarelli
• Journal of publication: J. Chem. Soc., Dalton Trans.
• Year of publication: 2000
• Journal issue: 13
• Pages of publication: 2067 - 2075
• a: 11.695 ± 0.004 Å
• b: 17.567 ± 0.007 Å
• c: 22.437 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4610 ± 3 ų
• Cell temperature: 203 K
• Ambient diffraction temperature: 203 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.1506
• Residual factor for significantly intense reflections: 0.091
• Weighted residual factors for all reflections: 0.2706
• Weighted residual factors for significantly intense reflections: 0.2259
• Goodness-of-fit parameter for all reflections: 1.024
• Goodness-of-fit parameter for significantly intense reflections: 1.116
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No