Information card for entry 4350440

Structure parameters

• Common name: TcCl4(THF)2
• Chemical name: Tetrachlorobis(tetrahydrofurane)technetium(IV)
• Formula: C8 H16 Cl4 O2 Tc
• Calculated formula: C8 H16 Cl4 O2 Tc
• SMILES: [Tc](Cl)(Cl)(Cl)(Cl)([O]1CCCC1)[O]1CCCC1
• Title of publication: Technetium tetrachloride as a precursor for small technetium(IV) complexes.
• Authors of publication: Hagenbach, Adelheid; Yegen, Eda; Abram, Ulrich
• Journal of publication: Inorganic chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 18
• Pages of publication: 7331 - 7338
• a: 7.7373 ± 0.0007 Å
• b: 12.6583 ± 0.0016 Å
• c: 13.9407 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1365.4 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0522
• Residual factor for significantly intense reflections: 0.0518
• Weighted residual factors for significantly intense reflections: 0.1419
• Weighted residual factors for all reflections included in the refinement: 0.1425
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No