Titir Das Gupta , Jackson Guite , LiWen Hirt , Xiaodong Zhang , James P. Donahue
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引用次数: 0
Abstract
Square-planar bis[1,2-bis(3,5-dimethylphenyl)ethylene-1,2-dithiolato(1–)]nickel(II) crystallizes on an inversion center in monoclinic P21/c in a packing arrangement defined by a dense network of intermolecular methyl C—H→πarene hydrogen bonds.
The title compound, [Ni(C18H18S2)2], 1, crystallizes upon an inversion center in monoclinic P21/c with intraligand C—S and C—Cchelate bond lengths that are indicative of the radical monoanionic redox level for the dithiolene ligand. The arene rings are canted at angles of 43.54 (4) and 71.36 (3)° with respect to the NiS4 plane. Molecules of 1 form columnar stacks along the a axis of the cell with a ∼59° angle between the molecular plane and the stacking axis. Adjacent stacks alternate in the directionality of their cant relative to the stacking axis such that a 37.2° angle is defined by the core NiS4 planes of molecules from adjoining columns. Intermolecular interactions are governed by methyl C—H→πarene hydrogen bonds, with each molecule enjoying four such interactions as acceptor and providing four such interactions as donor.
期刊介绍:
Acta Crystallographica Section E: Crystallographic Communications is the IUCr''s open-access structural communications journal. It provides a fast, simple and easily accessible publication mechanism for crystal structure determinations of inorganic, metal-organic and organic compounds. The electronic submission, validation, refereeing and publication facilities of the journal ensure rapid and high-quality publication of fully validated structures. The primary article category is Research Communications; these are peer-reviewed articles describing one or more structure determinations with appropriate discussion of the science.