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首页> 外文期刊>Zeitschrift fur Anorganische und Allgemeine Chemie >Dimethylhydroxyoxosulfonium(VI) Hexafluoridometallates, [(CH 33 ) 22 SO(O XX )] ++ [ MM F 66 ] –– ( XX = H, D; MM = As, Sb)
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Dimethylhydroxyoxosulfonium(VI) Hexafluoridometallates, [(CH 33 ) 22 SO(O XX )] ++ [ MM F 66 ] –– ( XX = H, D; MM = As, Sb)

机译:二甲基羟基氧磺酸核(VI)六氟氧磺酸盐,[(CH 3 3) 2 2 SO(O x / s> x)] + + [ m mf 6 6] - - ( x x = h,d; m < / i> m = AS,SB)

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摘要

> Dimethylsulfone reacts in the binary superacidic systems X F/ M F 5 ( X = H, D; M = As, Sb) under the formation of the corresponding salts of the type [(CH 3 ) 2 SO(O X )] + [ M F 6 ] – . The salts are characterized by low temperature vibrational spectroscopy. In case of [(CH 3 ) 2 SO(OH)] + [SbF 6 ] – a single‐crystal X‐ray structure analysis is reported. The salt crystallizes in the orthorhombic space group Pbca with eight formula units per unit cell [ a = 10.3281(3) ?, b = 12.2111(4) ?, c = 13.9593(4) ?]. The experimental results are discussed together with quantum chemical calculations on the PBE1PBE/6‐311G++(3pd,3df) level of theory.
机译: >二甲基砜在二元超酸盐系统中反应 x x×/μlm 5 ( x = h,d; m = aS,sb)在形成相应的盐的形成下[(ch 3 2 So(O x )] + [ m f 6 ] - 。盐的特征在于低温振动光谱。在[(Ch 3 2 so(OH)] + [sbf 6 ] - 报告单晶X射线结构分析。盐在正交间隔子间隙群中结晶,每单位细胞八条配方单位[ A = 10.3281(3)α, B = 12.2111( 4)?, c = 13.9593(4)?]。实验结果与PBE1PBE / 6-311g ++(3PD,3DF)理论水平的量子化学计算一起讨论。

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