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Structures of Two Spiropyrans in the Open and Closed Form

机译:开闭形式的两个螺旋藻的结构

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The crystal structure of the photochromism compound 3-{3,3-dimethyl-6'-nitrospiro[2'H-chromene-2,2'-(2,3-dihydro-lH-indole)]-l-yl}-propanoic acid,SP1,has been characterized by X-ray crystallography.We compared it with the crystal structure of 3-{2-[2-(3,5-dinitro-2-oxidophenyl)ethyl]-3,3-dimethyl-3H-indol-l-ium-l-yl}-propanoic acid.SP2 solvated with two DMF molecules that was obtained earlier.We found that great differences existed between them.Such differences can also be easily found by their[~1H]NMR and IR spectra.Their photochromic behaviors in solutions were investigated by UV-vis absorption with the aid of ultraviolet irradiation,leading to the conclusion that SP1 tended to the closed form while SP2 tended to be the open form both in solution and in the solid state.
机译:光致变色化合物3- {3,3-二甲基-6'-硝基螺[2'H-苯甲基-2,2'-(2,3-二氢-1H-吲哚)]-1-基}-的晶体结构丙酸SP1已通过X射线晶体学表征。我们将其与3- {2- [2-(2-(3,5-二硝基-2-氧化苯基)乙基] -3,3-二甲基- 3H-吲哚-1-基-1-基}-丙酸。SP2与较早获得的两个DMF分子溶剂化。我们发现它们之间存在很大的差异。通过它们的[〜1H] NMR也可以很容易地找到这些差异。借助紫外可见吸收法研究了它们在溶液中的光致变色行为,得出结论:SP1在溶液和固态下均趋向于封闭形式,而SP2趋于于开放态。 。

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