Information card for entry 4300117

Structure parameters

• Chemical name: meso-(mu!2$-Oxo)-bis[dichloro-(1,5,6-trimethylbenzimidazole)-(3,5-luti dine)-oxo-rhenium(v)] acetone solvate
• Formula: C35.5 H45 Cl4 N6 O3.5 Re2
• Calculated formula: C35.5 H41 Cl4 N6 O3.5 Re2
• Title of publication: Understanding the Orientation and Dynamic Motion of Planar Heterocyclic N-Donor Ligands by Exploiting the Symmetry Properties of Mixed-Ligand μ-Oxorhenium(V) Dinuclear Complexes [ReOCl2(L)(L')]-O-[ReOCl2(L)(L')]: A Combined X-ray Structural and Dynamic NMR Investigation
• Authors of publication: Enzo Alessio; Ennio Zangrando; Elisabetta Iengo; Michela Macchi; Patricia A. Marzilli; Luigi G. Marzilli
• Journal of publication: Inorganic Chemistry
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 294 - 303
• a: 17.113 ± 0.003 Å
• b: 20.744 ± 0.004 Å
• c: 23.302 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8272 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0582
• Residual factor for significantly intense reflections: 0.0522
• Weighted residual factors for all reflections: 0.1385
• Weighted residual factors for significantly intense reflections: 0.1354
• Goodness-of-fit parameter for all reflections: 1.097
• Goodness-of-fit parameter for significantly intense reflections: 1.146
• Diffraction radiation wavelength: 0.8 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No