Information card for entry 7001227

Structure parameters

• Formula: C43 H43 Cl17 O3 P2 Re2
• Calculated formula: C43 H43 Cl17 O3 P2 Re2
• SMILES: [Re](=O)(Cl)(Cl)(Cl)(Cl)O[Re](=O)(Cl)(Cl)(Cl)Cl.[P+](c1ccccc1)(c1ccccc1)(c1ccccc1)CC.[P+](c1ccccc1)(c1ccccc1)(c1ccccc1)CC.C(Cl)(Cl)Cl.ClC(Cl)Cl.ClC(Cl)Cl
• Title of publication: Remarkably stable dinuclear, diamagnetic rhenium(VI) salts with the [ReOCl4OReOCl4]2− anion
• Authors of publication: Hołyńska, Małgorzata; Lis, Tadeusz
• Journal of publication: Dalton Transactions
• Year of publication: 2009
• Journal issue: 19
• Pages of publication: 3840 - 3846
• a: 11.961 ± 0.005 Å
• b: 12.91 ± 0.005 Å
• c: 19.574 ± 0.008 Å
• α: 83.68 ± 0.03°
• β: 75.51 ± 0.03°
• γ: 78.86 ± 0.03°
• Cell volume: 2865 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0676
• Residual factor for significantly intense reflections: 0.0335
• Weighted residual factors for significantly intense reflections: 0.0537
• Weighted residual factors for all reflections included in the refinement: 0.0594
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No