采用密度泛函理论方法在B3LYP/6-31G(d)水平上对1,2-二苯基-2-[(1-苯乙基)氨基]乙醇分子进行了量子化学计算,quantum chemical calculation获得了分子的轨道能、键长、键角和电荷分布的数据,得出1,2-二苯基-2-[(1-苯乙基)氨基]乙醇分子...采用密度泛函理论方法在B3LYP/6-31G(d)水平上对1,2-二苯基-2-[(1-苯乙基)氨基]乙醇分子进行了量子化学计算,quantum chemical calculation获得了分子的轨道能、键长、键角和电荷分布的数据,得出1,2-二苯基-2-[(1-苯乙基)氨基]乙醇分子结构稳定,活性低,分子内难形成氢键的结论,为1,2-二苯基-2-[(1-苯乙基)氨基]乙醇分子晶体性质的研究提供了理论基础。展开更多
The extraction behavior of N,N′ diethyl N,N′ dibenzenyl urea (DEDBU) to Uranium? and Thorium? from nitric acid solution was studied by using xylene as diluent. The effects of aqueous HNO3 concentration and extractan...The extraction behavior of N,N′ diethyl N,N′ dibenzenyl urea (DEDBU) to Uranium? and Thorium? from nitric acid solution was studied by using xylene as diluent. The effects of aqueous HNO3 concentration and extractant concentration on the extraction distribution ratio of U? and Th? were studied, and the results show that the extraction behavior of the extractant to U? is similar to tributyl phosphate (TBP), the solvation numbers for DEDBU and TBP are two, respectively. Under the experiment condition, the extractant does not show the extraction behavior to Th?, this result exhibits that the extractant has good application to separate U? and Th?. The crystal structure of the complex UO2(NO3)2[CH2(CH2)2CONC8H17]2 was determined by single crystal X ray diffraction. Crystal data: C24H46N4O10U, triclinic, space group , a = 8.662(2)?, b = 10.07(2)?, c = 10.895(3)?, α = 103.77(2)°, β = 92.01(2)°, γ = 96.23(2)°, V = 915.7(4)?3, Mr = 934.78, Z = 1, Dc = 1.695 g·cm-3, F(000) = 462, μ = 4.495mm-1, R= 0.0250, wR = 0.0591, observed reflections 3566 (I >2σ(I)).The central uranyl ions is coordinated by six oxygen atoms, two of them are from the carbonyl groups of N,N′ diethyl N,N′ dibenzenyl urea molecules, and the other four are from two nitrate groups.展开更多
目的探讨敲低星形细胞上调基因-1(astrocyte elevated gene-1,AEG-1)表达对二乙基亚硝胺(diethylnitrosamine,DEN)诱导的原发性肝癌的调控。方法将60只大鼠随机分成Control组、DEN组、AEG-1 NC KO DEN组及AEG-1 KO DEN组,每组15只。除Co...目的探讨敲低星形细胞上调基因-1(astrocyte elevated gene-1,AEG-1)表达对二乙基亚硝胺(diethylnitrosamine,DEN)诱导的原发性肝癌的调控。方法将60只大鼠随机分成Control组、DEN组、AEG-1 NC KO DEN组及AEG-1 KO DEN组,每组15只。除Control组外,其余组均以DEN灌胃构建大鼠原发性肝癌模型,Control组和DEN组大鼠每日灌胃等体积生理盐水。AEG-1 KO DEN组和AEG-1 NC KO DEN组分别经腹腔注射稳定转染AEG-1shRNA或shRNA-NC慢病毒表达载体的HCCLM6。比较各组肝脏细胞损伤、凋亡、超氧化物歧化酶(superoxide dismutase,SOD)、丙二醛(malondialdehyde,MDA)和谷肽甘肽(glutathione peroxidase,GSH)、肝功能,血清IL-6、TNF-α含量,肝脏组织半胱氨酸蛋白酶3(caspase-3,Cas-3)、半胱氨酸蛋白酶9(caspase-9,Cas-9)表达及P65蛋白表达。结果DEN组AEG-1的表达水平明显高于Control组(P<0.05),AEG-1 KO DEN组的大鼠死亡率及腹水发生率低于DEN组(P<0.05);AEG-1 KO DEN组血清AST、ALT、IL-6和TNF-α水平低于DEN组(P<0.05),SOD活性高于DEN组(P<0.05),GSH和MDA含量低于DEN组(P<0.05),cleaved cas9/cas9、cleaved cas3/cas3和p-P65/P65蛋白表达低于DEN组(P<0.05)。结论AEG-1敲除可降低DEN诱导的大鼠的氧化应激水平以及炎症因子水平,减轻对肝脏组织的损伤,改善肝脏功能。展开更多
The extraction behavior of N,N-diethyl-N,N-dibenzenyl-urea（DEDBU）and N,N-dimethyl-N,N-dibenzenyl-urea（DMDBU）to uranium（VI）and thorium（IV）from nitric acid solution was studied by using xylene or chloroform as d...The extraction behavior of N,N-diethyl-N,N-dibenzenyl-urea（DEDBU）and N,N-dimethyl-N,N-dibenzenyl-urea（DMDBU）to uranium（VI）and thorium（IV）from nitric acid solution was studied by using xylene or chloroform as diluent.The effect of aqueous HNO3 concentration,extractant concentration,salting-out agent concentration and aqueous UO2+2/Th4+concentration on extraction distribution ratio of U（VI）and Th（IV）was determined.The results show that the extraction behavior of the extractants DEDBU and DMDBU to U（VI）is similar to that of TBP,the solvation numbers both are two.Under the experimental condition,the extractants DEDBU and DMDBU do not show the extraction behatvior to Th（IV）.This means that the estractants may have potential application to separate U（VI）and Th（IV）.展开更多
3-(1-Naphthyl)-2,5-diphenyl-2H-tetrazolium chloride was prepared from benzaldehyde-phenylhydrazone by coupling with 1-naphthylamine diazonium salt followed by oxidation with chlorine in 72%overall yield.
文摘采用密度泛函理论方法在B3LYP/6-31G(d)水平上对1,2-二苯基-2-[(1-苯乙基)氨基]乙醇分子进行了量子化学计算,quantum chemical calculation获得了分子的轨道能、键长、键角和电荷分布的数据,得出1,2-二苯基-2-[(1-苯乙基)氨基]乙醇分子结构稳定,活性低,分子内难形成氢键的结论,为1,2-二苯基-2-[(1-苯乙基)氨基]乙醇分子晶体性质的研究提供了理论基础。
文摘The extraction behavior of N,N′ diethyl N,N′ dibenzenyl urea (DEDBU) to Uranium? and Thorium? from nitric acid solution was studied by using xylene as diluent. The effects of aqueous HNO3 concentration and extractant concentration on the extraction distribution ratio of U? and Th? were studied, and the results show that the extraction behavior of the extractant to U? is similar to tributyl phosphate (TBP), the solvation numbers for DEDBU and TBP are two, respectively. Under the experiment condition, the extractant does not show the extraction behavior to Th?, this result exhibits that the extractant has good application to separate U? and Th?. The crystal structure of the complex UO2(NO3)2[CH2(CH2)2CONC8H17]2 was determined by single crystal X ray diffraction. Crystal data: C24H46N4O10U, triclinic, space group , a = 8.662(2)?, b = 10.07(2)?, c = 10.895(3)?, α = 103.77(2)°, β = 92.01(2)°, γ = 96.23(2)°, V = 915.7(4)?3, Mr = 934.78, Z = 1, Dc = 1.695 g·cm-3, F(000) = 462, μ = 4.495mm-1, R= 0.0250, wR = 0.0591, observed reflections 3566 (I >2σ(I)).The central uranyl ions is coordinated by six oxygen atoms, two of them are from the carbonyl groups of N,N′ diethyl N,N′ dibenzenyl urea molecules, and the other four are from two nitrate groups.
文摘目的探讨敲低星形细胞上调基因-1(astrocyte elevated gene-1,AEG-1)表达对二乙基亚硝胺(diethylnitrosamine,DEN)诱导的原发性肝癌的调控。方法将60只大鼠随机分成Control组、DEN组、AEG-1 NC KO DEN组及AEG-1 KO DEN组,每组15只。除Control组外,其余组均以DEN灌胃构建大鼠原发性肝癌模型,Control组和DEN组大鼠每日灌胃等体积生理盐水。AEG-1 KO DEN组和AEG-1 NC KO DEN组分别经腹腔注射稳定转染AEG-1shRNA或shRNA-NC慢病毒表达载体的HCCLM6。比较各组肝脏细胞损伤、凋亡、超氧化物歧化酶(superoxide dismutase,SOD)、丙二醛(malondialdehyde,MDA)和谷肽甘肽(glutathione peroxidase,GSH)、肝功能,血清IL-6、TNF-α含量,肝脏组织半胱氨酸蛋白酶3(caspase-3,Cas-3)、半胱氨酸蛋白酶9(caspase-9,Cas-9)表达及P65蛋白表达。结果DEN组AEG-1的表达水平明显高于Control组(P<0.05),AEG-1 KO DEN组的大鼠死亡率及腹水发生率低于DEN组(P<0.05);AEG-1 KO DEN组血清AST、ALT、IL-6和TNF-α水平低于DEN组(P<0.05),SOD活性高于DEN组(P<0.05),GSH和MDA含量低于DEN组(P<0.05),cleaved cas9/cas9、cleaved cas3/cas3和p-P65/P65蛋白表达低于DEN组(P<0.05)。结论AEG-1敲除可降低DEN诱导的大鼠的氧化应激水平以及炎症因子水平,减轻对肝脏组织的损伤,改善肝脏功能。
文摘The extraction behavior of N,N-diethyl-N,N-dibenzenyl-urea（DEDBU）and N,N-dimethyl-N,N-dibenzenyl-urea（DMDBU）to uranium（VI）and thorium（IV）from nitric acid solution was studied by using xylene or chloroform as diluent.The effect of aqueous HNO3 concentration,extractant concentration,salting-out agent concentration and aqueous UO2+2/Th4+concentration on extraction distribution ratio of U（VI）and Th（IV）was determined.The results show that the extraction behavior of the extractants DEDBU and DMDBU to U（VI）is similar to that of TBP,the solvation numbers both are two.Under the experimental condition,the extractants DEDBU and DMDBU do not show the extraction behatvior to Th（IV）.This means that the estractants may have potential application to separate U（VI）and Th（IV）.
文摘3-(1-Naphthyl)-2,5-diphenyl-2H-tetrazolium chloride was prepared from benzaldehyde-phenylhydrazone by coupling with 1-naphthylamine diazonium salt followed by oxidation with chlorine in 72%overall yield.
