Information card for entry 7043750

Structure parameters

• Formula: C18 H32 Cl6 Cu N8 O2 Re
• Calculated formula: C18 H32 Cl6 Cu N8 O2 Re
• Title of publication: Magneto-structural correlations in a family of ReIVCuII chains based on the hexachlororhenate(IV) metalloligand
• Authors of publication: Brechin, Euan K.; Pedersen, Anders Hjordt H.; Julve, Miguel; Martínez-Lillo, José; Cano, Joan
• Journal of publication: Dalton Trans.
• Year of publication: 2017
• a: 10.1219 ± 0.0002 Å
• b: 11.0652 ± 0.0003 Å
• c: 14.7016 ± 0.0004 Å
• α: 76.032 ± 0.002°
• β: 80.918 ± 0.002°
• γ: 69.748 ± 0.002°
• Cell volume: 1494.12 ± 0.07 ų
• Cell temperature: 292.61 ± 0.1 K
• Ambient diffraction temperature: 292.61 ± 0.1 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0213
• Residual factor for significantly intense reflections: 0.0192
• Weighted residual factors for significantly intense reflections: 0.0361
• Weighted residual factors for all reflections included in the refinement: 0.0367
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No