Information card for entry 4101616

Structure parameters

• Formula: C29.66 H10 B Cl4 N10.33 Re
• Calculated formula: C29.66 H10 B Cl4 Cu N10.33 Re
• Title of publication: Record ferromagnetic exchange through cyanide and elucidation of the magnetic phase diagram for a Cu(II)Re(IV)(CN)2 chain compound.
• Authors of publication: Harris, T. David; Coulon, Claude; Clérac, Rodolphe; Long, Jeffrey R.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2011
• Journal volume: 133
• Journal issue: 1
• Pages of publication: 123 - 130
• a: 11.4534 ± 0.0007 Å
• b: 16.2945 ± 0.001 Å
• c: 22.1655 ± 0.0013 Å
• α: 90°
• β: 90.677 ± 0.001°
• γ: 90°
• Cell volume: 4136.4 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0717
• Residual factor for significantly intense reflections: 0.0684
• Weighted residual factors for significantly intense reflections: 0.1882
• Weighted residual factors for all reflections included in the refinement: 0.1889
• Goodness-of-fit parameter for all reflections included in the refinement: 2.824
• Diffraction radiation wavelength: 0.7749 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No