Information card for entry 2215964

Structure parameters

• Chemical name: bis(methyltriphenylphosphonium) hexachloridorhenate(IV)
• Formula: C38 H36 Cl6 P2 Re
• Calculated formula: C38 H36 Cl6 P2 Re
• SMILES: [P+](c1ccccc1)(c1ccccc1)(C)c1ccccc1.[Re](Cl)(Cl)(Cl)(Cl)([Cl-])[Cl-].[P+](C)(c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Redetermination of bis(methyltriphenylphosphonium) hexachloridorhenate(IV)
• Authors of publication: Hołyńska, Małgorzata; Korabik, Maria; Lis, Tadeusz
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 11
• Pages of publication: m2859 - m2859
• a: 9.155 ± 0.004 Å
• b: 16.429 ± 0.005 Å
• c: 12.964 ± 0.005 Å
• α: 90°
• β: 101.61 ± 0.03°
• γ: 90°
• Cell volume: 1910 ± 1.3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1184
• Residual factor for significantly intense reflections: 0.0529
• Weighted residual factors for significantly intense reflections: 0.0483
• Weighted residual factors for all reflections included in the refinement: 0.056
• Goodness-of-fit parameter for all reflections included in the refinement: 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes