首页> 外文期刊>Journal of Solution Chemistry >On the Dissociation of Methyl Orange:Spectrophotometric Investigation in Aqueous Solutions from 10 to 90 deg C and Theoretical Evidence for Intramolecular Dihydrogen Bonding
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On the Dissociation of Methyl Orange:Spectrophotometric Investigation in Aqueous Solutions from 10 to 90 deg C and Theoretical Evidence for Intramolecular Dihydrogen Bonding

机译:甲基橙的解离:10至90℃水溶液中的分光光度法研究及分子内二氢键合的理论证据

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摘要

The dissociation of methyl orange was investigated by spectrophotometry in aqueous solutions from 10 to 90 deg C and by quantum chemical calculations.Combined chemo-metric and thermodynamic analyses of the spectrophotometric data were used to simultaneously extract the thermodynamic stabilities and the spectrophotometric attributes of the dominant methyl orange species in solutions containing less than 20.00 mmol-kg~(-1) perchloric acid and submillimolal concentrations of methyl orange.The analyses revealed the presence of only one monomeric deprotonated and one monomeric proto-nated species.The spectra did not reveal any evidence for the presence of tautomeric equilibria between the protonated azo and ammonium species in the experimental range studied.Thermodynamic analyses of the temperature-dependent dissociation constants showed the reactions to be endothermic and enthalpy driven with increasing acidity and increasing temperature.
机译:通过分光光度法在10至90摄氏度的水溶液中进行量子化学计算,研究了甲基橙的解离作用。结合化学计量学和热力学分析对分光光度数据进行分析,同时提取了主要成分的热力学稳定性和分光光度属性高氯酸浓度低于20.00 mmol-kg〜(-1)且溶液的亚摩尔浓度为甲基橙的甲基橙物质,分析显示仅存在一种去质子化单体和一种质子化的单体,光谱图中未发现任何在所研究的实验范围内,质子化的偶氮和铵物种之间存在互变异构平衡的证据。对温度相关的解离常数的热力学分析表明,随着酸度的升高和温度的升高,反应是吸热和焓驱动的。

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