Information card for entry 7024888

Structure parameters

• Common name: Tellurium Tetrachloride Acetonitrile Solvate
• Chemical name: Tellurium Tetrachloride Acetonitrile Solvate
• Formula: C4 H6 Cl4 N2 Te
• Calculated formula: C4 H6 Cl4 N2 Te
• SMILES: [Te](Cl)(Cl)(Cl)(Cl)([N]#CC)[N]#CC
• Title of publication: The structures of tellurium(IV) halides in the gas phase and as solvated molecules.
• Authors of publication: Shlykov, Sergey A.; Giricheva, Nina I.; Titov, Anton V.; Szwak, Małgorzata; Lentz, Dieter; Girichev, Georgiy V.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 13
• Pages of publication: 3245 - 3255
• a: 5.9326 ± 0.0011 Å
• b: 7.4523 ± 0.0014 Å
• c: 12.619 ± 0.002 Å
• α: 88.75 ± 0.004°
• β: 88.661 ± 0.004°
• γ: 84.977 ± 0.004°
• Cell volume: 555.5 ± 0.17 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0218
• Residual factor for significantly intense reflections: 0.0195
• Weighted residual factors for significantly intense reflections: 0.0497
• Weighted residual factors for all reflections included in the refinement: 0.0508
• Goodness-of-fit parameter for all reflections included in the refinement: 1.041
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No