Information card for entry 4322179

Structure parameters

• Chemical name: Bis(phenylthiolato)tellurium
• Formula: C12 H10 S2 Te
• Calculated formula: C12 H10 S2 Te
• SMILES: c1(ccccc1)S[Te]Sc1ccccc1
• Title of publication: Experimental Investigations and Ab Initio Studies of Tellurium(II) Dithiolates, Te(SR)2
• Authors of publication: Holger Fleischer; Sandra Stauf; Dieter Schollmeyer
• Journal of publication: Inorganic Chemistry
• Year of publication: 1999
• Journal volume: 38
• Pages of publication: 3725 - 3729
• a: 15.598 ± 0.003 Å
• b: 10.44 ± 0.002 Å
• c: 7.533 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1226.7 ± 0.6 ų
• Cell temperature: 198 ± 2 K
• Ambient diffraction temperature: 194 ± 2 K
• Number of distinct elements: 4
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.1154
• Residual factor for significantly intense reflections: 0.044
• Weighted residual factors for significantly intense reflections: 0.0761
• Weighted residual factors for all reflections included in the refinement: 0.0946
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No