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41.
设计并合成了2-(2’-羟基-3’-甲氧基苯基)-5,6-二硝基苯并咪唑化合物(1),通过X射线单晶衍射研究了该化合物的固态结构.利用紫外-可见光谱技术研究了其对阴离子的识别,发现化合物1能够在DMSO中对AcO^-,H2PO4^-,OH^-的3种离子进行有效识别,同时溶液由原来的黄色变成红色,实现裸眼检测. 相似文献
42.
YiJianCHEN GuiYingXU ShiLingYUAN HaiYingSUN 《中国化学快报》2005,16(5):688-690
Molecular dynamics (MD) simulation are used to study the properties of gemini surfactant of ethyl-α,ω-bis(dodecyldimethylammonium bromide) (C12C2C12) and dodecyl-trimethylammonium bromide (DTAB) at the air/water interface, respectively. In the two systems,t he surfactant concentrations are both 28 wt.%, and other conditions are also the same. After reaching the thermodynamic equilibrium, the concentration profiles, the radial distributions functions (RDF) and the mean squared displacement (MSD) are investigated. The results reveal that the surface activity of C12C2C12 surfactant is higher than DTAB surfactant. 相似文献
43.
A New Asterosaponin from the Starfish Culcita novaeguineae 总被引:1,自引:0,他引:1
HaiFengTANG YangHuaYI LingLI PengSUN DaZhengZHOU BaoShuLIU 《中国化学快报》2005,16(5):619-622
A new asterosaponin named novaeguinoside A, along with a known saponin, asteronyl pentaglycoside sulfate, was isolated from the starfish Culcita novaeguineae. The new compound was identitied to be sodium 6α-O-{β-D-fucopyranosyl-(1→2)-β-D-fucopyranosyl-(1→4)-[β-D-quinovopyranosyl-(1→2)]-β-D-xylopyranosyl-(1→3)-[β-D-quinovopyranosyl}-5α-pregn-9(11)-en-20-one-3β-yl-sulfate by extensive spectral analysis and chemical evidence. 相似文献
44.
对硝基苯磺酰基乙酸酯与α,β-不饱和酸酯类化合物在固液相转移条件下的反应 总被引:3,自引:0,他引:3
在固液相转移催化(K_2CO_3/DMF/TEBA)条件下,对硝基苯磺酰基乙酸酯与α,β-不饱和酸酯反应意外地生成加成重排产物[如生成2-甲基-2-(对硝基苯基)戊二酸-1-甲酯-5-乙酯]。其反应机理可能是砜酯首先与α,β-不饱和酯起Michael反应,随后加成物发生分子内芳环上的亲核性取代,酸化后脱去SO2得最终产物。 相似文献
45.
SynthesesandCharacterizationsof(η~5-C_5H_5)MoFeCo(CO)_8(μ_3-S)and(η~5-C_5H_5)_2Mo_2Fe(CO)_7(μ_3-S):X-rayCrystalStructureof(η~5-C_5H_... 相似文献
46.
47.
The title compound, {[Cu(2,2'-bipy)(C7H4O5S)(H2O)2](H2O}n (2,2'-bipy = 2,2'- bipyridine), was synthesized by the hydrothermal reaction of Cu(NO3)2(3H2O, 2,2'-bipyridine and 2-sulphobenzoic acid, and structurally characterized by single-crystal X-ray diffraction analysis. The crystal is of triclinic, space group P with a = 9.21(3), b = 10.17(3), c = 10.77(3) (A), α = 77.017(16), β = 89.80(8), γ = 68.46(7)°, V = 911(5) (A)3, Z = 2, (D/s)max = 0.001, Mr = 473.94, Dc = 1.728 g/cm3, μ(MoKα) = 1.365 mm-1, F(000) = 486, the final R = 0.0246 and wR = 0.0628 for 3809 observed reflections with I > 2σ(I). The mononuclear crystal structure extends into a two-dimensional net- work via hydrogen-bonding interactions and a three-dimensional framework is further formed by means of π-π stacking interactions. 相似文献
48.
49.
Xin Gen Luo Hai Sheng Chen Shuang Liang Mao Huang Wei Dong Xuan Li Jin College of Pharmacy Second Military Medical University Shanghai China Department of Pharmacy Guangzhou Military General Hospital Guangzhou China Center of New Drug Evaluation Institute of Basic Medical Sciences Second Military Medical University Shanghai China 《中国化学快报》2007,18(6):697-699
Six indole alkaloids were isolated from the stems of Ervatamia yunnanensis. Among them, yunnanensine (I) is new. The other five are known alkaloids, namely: 19,20-E-vallesamine (II), 19s-heyneanine (HI), ibogaine (IV), ibogamine (V), coronaridine (VI). The structural elucidation of the alkaloids was based on spectral means. 相似文献
50.
Xiu Hui Lu Hai Bin Yu Wei Rong Wu Yue Hua Xu 《International journal of quantum chemistry》2007,107(2):451-457
Mechanisms of the cycloaddition reaction between singlet difluoromethylene carbene and acetone have been investigated with the second‐order Møller–Plesset (MP2)/6‐31G* method, including geometry optimization and vibrational analysis. Energies for the involved stationary points on the potential energy surface (PES) are corrected by zero‐point energy (ZPE) and CCSD(T)/6‐31G* single‐point calculations. From the PES obtained with the CCSD(T)//MP2/6‐31G* method for the cycloaddition reaction between singlet difluoromethylene carbene and acetone, it can be predicted that path B of reactions 2 and 3 should be two competitive leading channels of the cycloaddition reaction between difluoromethylene carbene and acetone. The former consists of two steps: (i) the two reactants first form a four‐membered ring intermediate, INT2, which is a barrier‐free exothermic reaction of 97.8 kJ/mol; (ii) the intermediate INT2 isomerizes to a four‐membered product P2b via a transition state TS2b with an energy barrier of 24.9 kJ/mol, which results from the methyl group transfer. The latter proceeds in three steps: (i) the two reactants first form an intermediate, INT1c, through a barrier‐free exothermic reaction of 199.4 kJ/mol; (ii) the intermediate INT1c further reacts with acetone to form a polycyclic intermediate, INT3, which is also a barrier‐free exothermic reaction of 27.4 kJ/mol; and (iii) INT3 isomerizes to a polycyclic product P3 via a transition state TS3 with an energy barrier of 25.8 kJ/mol. © 2006 Wiley Periodicals, Inc. Int J Quantum Chem, 2007 相似文献