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2 - ((E)-{3 - [(E)-2 - 羟基 - 3,5 - 二碘苄叉基氨基] - 2,2 - 二甲基丙基}亚氨基甲基)- 4,6 - 二碘苯酚

2-((E)-{3-[(E)-2-Hy-droxy-3,5-diiodo-benzyl-idene-amino]-2,2-dimethyl-prop-yl}imino-meth-yl)-4,6-diiodo-phenol.

作者信息

Kargar Hadi, Kia Reza, Shakarami Tayebeh, Tahir Muhammad Nawaz

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2012 Mar 1;68(Pt 3):o564. doi: 10.1107/S1600536812003704. Epub 2012 Feb 4.

Abstract

The asymmetric unit of the title compound, C(19)H(18)I(4)N(2)O(2), comprises a potentially tetra-dentate Schiff base ligand. The disordered H atoms on the N and O atoms were refined with site occupancies of 0.54 (8)/0.46 (8) and 0.59 (7)/0.41 (7), respectively. The dihedral angle between the benzene rings is 73.3 (3)°. Intra-molecular O-H⋯N and N-H⋯O hydrogen bonds make S(6) ring motifs. Short I⋯I [3.8919 (7) Å] and I⋯Cg [Cg is a ring centroid; 3.911 (2) Å] contacts are present in the crystal structure. The crystal structure is further stabilized by inter-molecular π-π inter-actions [centroid-to-centroid distance = 3.827 (3) Å].

摘要

标题化合物C(19)H(18)I(4)N(2)O(2)的不对称单元包含一个潜在的四齿席夫碱配体。N和O原子上无序的H原子分别以0.54 (8)/0.46 (8)和0.59 (7)/0.41 (7)的位点占有率进行精修。苯环之间的二面角为73.3 (3)°。分子内的O-H⋯N和N-H⋯O氢键形成S(6)环模式。晶体结构中存在短的I⋯I [3.8919 (7) Å]和I⋯Cg [Cg为环心;3.911 (2) Å]接触。晶体结构通过分子间的π-π相互作用[质心到质心距离 = 3.827 (3) Å]进一步稳定。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/68c3/3297293/dca0a11e47d1/e-68-0o564-fig1.jpg

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