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{5,5'-双(二乙氨基)-2,2'-[(2,2-二甲基丙烷-1,3-二亚基)双(腈基亚甲基)]二酚根合}二氧化钼(VI)

{5,5'-Bis(diethyl-amino)-2,2'-[(2,2-dimethyl-propane-1,3-di-yl)bis-(nitrilo-methanylyl-idene)]diphenolato}dioxido-molybdenum(VI).

作者信息

Kargar Hadi, Kia Reza

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2011 Oct 1;67(Pt 10):m1348. doi: 10.1107/S1600536811035069. Epub 2011 Sep 14.

Abstract

In the title compound, [Mo(C(27)H(38)N(4)O(2))O(2)], the Mo(VI) atom is coordinated by two oxide O atoms and by two O and two N atoms of the tetra-dentate Schiff base ligand in a distorted octa-hedral geometry. The Mo-N bond trans to a terminal oxide group is significantly longer than the other Mo-N bond, which is attributed to the strong trans effect of the oxide O atom. The dihedral angle formed between the substituted benzene rings is 71.79 (14)°. One of the ethyl groups is disordered over two sets of sites, with a refined site-occupancy ratio of 0.588 (18):0.412 (18).

摘要

在标题化合物[Mo(C₂₇H₃₈N₄O₂)O₂]中,Mo(VI)原子由两个氧化物O原子以及四齿席夫碱配体的两个O原子和两个N原子配位,形成扭曲的八面体几何构型。与末端氧化物基团相对的Mo-N键明显长于其他Mo-N键,这归因于氧化物O原子的强反位效应。取代苯环之间形成的二面角为71.79 (14)°。其中一个乙基在两组位置上无序,精修后的位点占有率为0.588 (18):0.412 (18)。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/64bb/3201348/73c126864e29/e-67-m1348-fig1.jpg

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