Information card for entry 7015607

Structure parameters

• Formula: C26 H25 Cu Fe4 N2 O12
• Calculated formula: C26 H25 Cu Fe4 N2 O12
• Title of publication: Structural variations, electrochemical properties and computational studies on monomeric and dimeric Fe-Cu carbide clusters, forming copper-based staple arrays.
• Authors of publication: Pergola, Roberto Della; Bruschi, Maurizio; Sironi, Annalisa; Manassero, Mario; Manassero, Carlo; Strumolo, Donatella; Fedi, Serena; Zanello, Piero
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 20
• Pages of publication: 5464 - 5475
• a: 14.6999 ± 0.0009 Å
• b: 12.4817 ± 0.0007 Å
• c: 18.7043 ± 0.0011 Å
• α: 90°
• β: 106.51 ± 0.001°
• γ: 90°
• Cell volume: 3290.4 ± 0.3 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Goodness-of-fit parameter for all reflections: 0.96
• Goodness-of-fit parameter for all reflections included in the refinement: 0.96
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No