首页> 外文OA文献 >Structures of trans-PtCl2(PBz3)2, trans-PtI2(PBz3)2, trans-Pt(NCS)2(PBz3)2 small middle dot0.5C6H6 and trans-PdI2(PBz3)2.
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Structures of trans-PtCl2(PBz3)2, trans-PtI2(PBz3)2, trans-Pt(NCS)2(PBz3)2 small middle dot0.5C6H6 and trans-PdI2(PBz3)2.

机译:反式ptCl2(pBz3)2,反式 - ptI2(pBz3)2,反式 - pt(NCs)2(pBz3)2小中间点0.5C6H6和反式 - pdI2(pBz3)2的结构。

摘要

A series of structures of trans-[MX(2)(PBz(3))(2)] [M = Pt, X = Cl(-); PBz(3) = tribenzylphosphine (1), I(-), trans-diiodobis(tribenzylphosphine)platinum(II) (2), and NCS(-), trans-di(thiocyanate)bis(tribenzylphosphine)platinum(II) (3); M = Pd, X = I(-), trans-diiodobis(tribenzylphosphine)palladium(II) (4)] have been characterized by X-ray crystallography. In all compounds each tribenzylphosphine has one benzylcarbon close to the coordination plane. In (1), (2) and (4) those (in-plane) C atoms, from the two different PBz(3), exhibit an anti conformation along the P-P axis, while (3) has the gauche conformation. Root mean square (RMS) calculations and half-normal probability plots show that the complexes in (2) and (4) are very similar and the only significant differences between them are the M-P bonds, 2.354 (4) and 2.330 (5) A, and the M-I bond distances, 2.604 (1) and 2.611 (2) A, for Pd and Pt, respectively. Calculations of the steric demand of the PBz(3) ligands based on the Tolman model gave values ranging from 155 to 178 degrees for the effective and 156 to 179 degrees for the Tolman angles, respectively.
机译:反式-[MX(2)(PBz(3))(2)]的一系列结构[M = Pt,X = Cl(-); PBz(3)=三苄基膦(1),I(-),反式二碘双(三苄基膦)铂(II)(2)和NCS(-),反式二(硫氰酸盐)双(三苄基膦)铂(II)( 3); M = Pd,X = I(-),反式二碘代双(三苄基膦)钯(II)(4)已通过X射线晶体学表征。在所有化合物中,每个三苄基膦在配位平面附近具有一个苄基碳。在(1),(2)和(4)中,来自两个不同PBz(3)的那些(平面内)C原子沿P-P轴显示反构象,而(3)具有gauche构象。均方根(RMS)计算和半正态概率图显示(2)和(4)中的复数非常相似,它们之间唯一的显着区别是MP键,2.354(4)和2.330(5)A Pd和Pt的MI键距分别为2.604(1)和2.611(2)A。 PBz(3)配体的空间需求的计算基于托尔曼模型给出的值范围分别为有效角度从155至178度和托尔曼角度从156至179度。

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