Information card for entry 4319712

Structure parameters

• Formula: C25 H15 Br2 Cl2 N6 O7 Re2
• Calculated formula: C26.16 H15.16 Br2 Cl2 N5 O7 Re2
• Title of publication: Rhenium(I) Carbonyl Complexes of 2,4,6-Tris(2-pyridyl)-1,3,5-triazine (TPT). Rhenium(I)-Promoted Methoxylation of the Triazine Ring Carbon Atom in Dinuclear Rhenium Complexes
• Authors of publication: Xiaoyuan Chen; Frank J. Femia; John W. Babich; Jon A. Zubieta
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 2769 - 2777
• a: 17.555 ± 0.004 Å
• b: 15.277 ± 0.003 Å
• c: 13.093 ± 0.003 Å
• α: 90°
• β: 111.179 ± 0.003°
• γ: 90°
• Cell volume: 3274.2 ± 1.2 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0527
• Residual factor for significantly intense reflections: 0.0411
• Weighted residual factors for significantly intense reflections: 0.1097
• Weighted residual factors for all reflections included in the refinement: 0.122
• Goodness-of-fit parameter for all reflections included in the refinement: 1.117
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No