Crystal structure at 100 K of bis-[1,2-bis-(di-phenyl-phosphan-yl)ethane]-nickel(II) bis-(tri-fluoro-methane-sulfonate): a possible negative thermal expansion mol-ecular material

双-[1,2-双-(二苯基膦基)乙烷]-镍(II)双-(三氟甲烷磺酸盐)在100 K下的晶体结构:一种可能的负热膨胀分子材料

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Abstract

In the title salt, [Ni(C(26)H(24)P(2))(2)](CF(3)SO(3))(2) or [Ni(dppe)(2)](2+)·(OTf(-))(2) [dppe = 1,2-bis-(di-phenyl-phosphan-yl)ethane and OTf(-) = tri-fluoro-methane-sulfonate], the Ni atom (site symmetry ) has a square-planar geometry with the bidentate ligands chelating the metal. As a result of the steric hindrance of the phenyl rings, the counter-ions are blocked from the metal coordination sphere. The dynamic disorder of the anion existing at 296 K is reduced at 100 K and based on these two temperatures, negative thermal expansion behaviour is observed.

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