Information card for entry 4310942

Structure parameters

• Formula: C56 H100 Cl4 Cu6 N16 O28
• Calculated formula: C56 H100 Cl4 Cu6 N16 O28
• Title of publication: Spin Control in Ladderlike Hexanuclear Copper(II) Complexes with Metallacyclophane Cores
• Authors of publication: Emilio Pardo; Kevin Bernot; Miguel Julve; Francesc Lloret; Joan Cano; Rafael Ruiz-García; Fernando S. Delgado; Catalina Ruiz-Pérez; Xavier Ottenwaelder; Yves Journaux
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 2768 - 2770
• a: 21.47 ± 0.004 Å
• b: 21.508 ± 0.005 Å
• c: 20.3051 ± 0.0017 Å
• α: 93.678 ± 0.01°
• β: 93.388 ± 0.011°
• γ: 85.662 ± 0.013°
• Cell volume: 9316 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2658
• Residual factor for significantly intense reflections: 0.183
• Weighted residual factors for significantly intense reflections: 0.3987
• Weighted residual factors for all reflections included in the refinement: 0.4377
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No