Information card for entry 2004029

Structure parameters

• Chemical name: Tris(diethyldithiocarbamato)-4-methoxyphenyltellurium(IV)
• Formula: C22 H37 N3 O S6 Te
• Calculated formula: C22 H37 N3 O S6 Te
• SMILES: [Te]123(SC(=[S]1)N(CC)CC)([S]=C(S2)N(CC)CC)(SC(=[S]3)N(CC)CC)c1ccc(OC)cc1
• Title of publication: Tris(diethyldithiocarbamato)(4-methoxyphenyl)tellurium(IV), <i>p</i>-MeOC~6~H~4~Te(S~2~CNEt~2~)~3~, and the Triclinic Modification of Tris(diethyldithiocarbamato)phenyltellurium(IV), PhTe(S~2~CNEt~2~)~3~
• Authors of publication: Husebye, S.; Lindeman, S. V.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 10
• Pages of publication: 2152 - 2157
• a: 10.859 ± 0.002 Å
• b: 18.443 ± 0.003 Å
• c: 15.299 ± 0.005 Å
• α: 90°
• β: 92.66 ± 0.02°
• γ: 90°
• Cell volume: 3060.7 ± 1.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.1063
• Residual factor for significantly intense reflections: 0.0328
• Weighted residual factors for all reflections: 0.1631
• Weighted residual factors for significantly intense reflections: 0.0849
• Goodness-of-fit parameter for all reflections: 1.093
• Goodness-of-fit parameter for significantly intense reflections: 1.07
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No