Information card for entry 7114494

Structure parameters

• Formula: C28 H41 Cl4 N7 O13 Zn
• Calculated formula: C28 H25 Cl4 N7 O13 Zn
• Title of publication: A copper(ii) complex of a pentadentate ligand featuring large ferro- and antiferromagnetic interactionsElectronic supplementary information (ESI) available: magnetic data. See http://www.rsc.org/suppdata/cc/b2/b204899j/
• Authors of publication: Stroh, Christophe; Ziessel, Raymond
• Journal of publication: Chemical Communications
• Year of publication: 2002
• Journal issue: 17
• Pages of publication: 1916
• a: 15.4545 ± 0.0003 Å
• b: 15.4545 ± 0.0003 Å
• c: 13.5594 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 2804.67 ± 0.1 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 6
• Space group number: 145
• Hermann-Mauguin space group symbol: P 32
• Hall space group symbol: P 32
• Residual factor for all reflections: 0.084
• Residual factor for significantly intense reflections: 0.075
• Weighted residual factors for all reflections: 0.129
• Weighted residual factors for all reflections included in the refinement: 0.096
• Goodness-of-fit parameter for all reflections: 1.784
• Goodness-of-fit parameter for all reflections included in the refinement: 1.33
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No