Information card for entry 4325483

Structure parameters

• Formula: C40 H26 Cl5 N6 O9 Re3
• Calculated formula: C40 H26 Cl5 N6 O9 Re3
• Title of publication: Complete Family of Mono-, Bi-, and Trinuclear ReI(CO)3Cl Complexes of the Bridging Polypyridyl Ligand 2,3,8,9,14,15-Hexamethyl-5,6,11,12,17,18-hexaazatrinapthalene: Syn/Anti Isomer Separation, Characterization, and Photophysics
• Authors of publication: Michael G. Fraser; Charlotte A. Clark; Raphael Horvath; Samuel J. Lind; Allan G. Blackman; Xue-Zhong Sun; Michael W. George; Keith C. Gordon
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 6093 - 6106
• a: 18.002 ± 0.002 Å
• b: 22.581 ± 0.003 Å
• c: 11.232 ± 0.0015 Å
• α: 90°
• β: 95.731 ± 0.008°
• γ: 90°
• Cell volume: 4543 ± 1 ų
• Cell temperature: 91 ± 2 K
• Ambient diffraction temperature: 91 ± 2 K
• Number of distinct elements: 6
• Space group number: 12
• Hermann-Mauguin space group symbol: C 1 2/m 1
• Hall space group symbol: -C 2y
• Residual factor for all reflections: 0.0381
• Residual factor for significantly intense reflections: 0.0354
• Weighted residual factors for significantly intense reflections: 0.0931
• Weighted residual factors for all reflections included in the refinement: 0.0954
• Goodness-of-fit parameter for all reflections included in the refinement: 1.101
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No