Information card for entry 7001226

Structure parameters

• Formula: C38 H34 Cl8 O3 P2 Re2
• Calculated formula: C38 H34 Cl8 O3 P2 Re2
• SMILES: C([P+](c1ccccc1)(c1ccccc1)c1ccccc1)C[P+](c1ccccc1)(c1ccccc1)c1ccccc1.O([Re](=O)(Cl)(Cl)(Cl)Cl)[Re](=O)(Cl)(Cl)(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: 9.102 ± 0.003 Å
• b: 10.762 ± 0.003 Å
• c: 11.888 ± 0.003 Å
• α: 100.65 ± 0.03°
• β: 111.63 ± 0.03°
• γ: 90.37 ± 0.03°
• Cell volume: 1060.3 ± 0.6 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: 0.1552
• Residual factor for significantly intense reflections: 0.0522
• Weighted residual factors for significantly intense reflections: 0.0633
• Weighted residual factors for all reflections included in the refinement: 0.0765
• Goodness-of-fit parameter for all reflections included in the refinement: 0.709
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No