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161.
I. L. Fedushkin A. N. Lukoyanov G. K. Fukin M. Hummert H. Schumann 《Russian Chemical Bulletin》2006,55(7):1177-1183
Reduction of benzophenone and 4,4′-bis(methoxy)benzophenone with the aluminum complex (dpp-BIAN)AlI(Et2O) (1) containing the dianionic dpp-BIAN ligand (dpp-BIAN is 1,2-bis[(2,6-diisopropylphenyl)imino]acenaphthene) affords the pinacolate
complexes [(dpp-BIAN)AlI]2[μ-O2C2Ph4] (2) and [(dpp-BIAN)AlI]2[μ-O2C2(C6H4OMe)4] (3), respectively, which undergo the pinacolone rearrangement upon prolonged storage in diethyl ether to form [(dpp-BIAN)AlI]2O (4). The reaction of 1 with fluoren-9-one produces stable pinacolate (dpp-BIAN)Al[μ-O2(C13H8)2] (7) and the (dpp-BIAN)AlI2 complex (8). Compounds 2—4, 7, and 8 were characterized by ESR spectroscopy. Hydrolysis products of compounds 2 and 3 were characterized by 1H NMR spectroscopy. The structures of complexes 4 and 7 were established by X-ray diffraction.
dpp-BIAN is 1,2-bis[(2,6-diisopropylphenyl)imino]acenaphthene
Published in Russian in Izvestiya Akademii Nauk. Seriya Khimicheskaya, No. 7, pp. 1134–1140, July, 2006. 相似文献
162.
Keggin结构杂多酸盐[(C2H5)4N]3[PMo12O40]单晶的水热合成及其结构表征 总被引:1,自引:0,他引:1
将苯基磷酸和CoCl2.6H2O,Na2MoO4.2H2O,MoO3混合,采用水热合成的方法制备出了标题化合物[(C2H5)4N]3[PMo12O40],并对其结构进行了X射线单晶衍射的测定.此晶体属于立方晶系,空间群为Cmca,晶体数据为a=1.9777(2)nm,b=1.6882(2)nm,c=1.7161(3)nm,α=90.00°,β=90.00°,γ=90.00°,V=5.7299(13)nm3,Z=4,R1=0.0533,wR2=0.1219.标题化合物含有四乙基胺阳离子和十二钼磷酸的阴离子,其中十二钼磷酸的阴离子具有典型的Keggin结构. 相似文献
163.
Dr. Gang Li Yuechao Wu Dr. Junkuo Gao Junbo Li Prof. Dr. Yang Zhao Prof. Dr. Qichun Zhang 《化学:亚洲杂志》2013,8(7):1574-1578
Two novel larger azaacenes with six or ten N atoms in their backbones, benzannelated 9,11,13,22,24,26‐hexazatetrabenzo[a,c,l,n]heptacene ( HATBH , 1 ) and benzannelated 9,26‐dihydro‐9,11,13,22,24,26‐hexaza‐tetrapyrido[3,2‐a: 2′,3′‐c: 3′′,2′′‐l: 2′′′,3′′′‐n]heptacene ( DHATPH, 2 ), have been successfully synthesized in two steps. The theoretical band gaps estimated through DFT calculations for HATBH ( 1 ) and DHATPH ( 2 ) are 1.949 eV and 2.278 eV, which are close to the experimentally obtained optical band gaps (2.14 eV and 2.39 eV). Interestingly, HATBH ( 1 ) can act as efficient anion sensor for F? and H2PO4?, while DHATPH ( 2 ) selectively responds to F? among the ten different anions used (F?, Cl?, Br?, I?, PF6?, HSO4?, NO3?, BF4?, AcO?, and H2PO4?). Our synthetic strategy could offer a promising and easy way to obtain even larger azaacenes. 相似文献
164.
Chui‐Peng Kong Zeng‐Xia Zhao Hong‐Xing Zhang 《International journal of quantum chemistry》2013,113(9):1416-1421
Complete active space self‐consistent field (CASSCF) and complete active space second‐order perturbation theory (CASPT2) calculations in conjunction with the aug‐cc‐pVTZ basis set have been used to investigate the low‐lying electronic states of thiofulminic acid (HCNS), HCNS+, and HCNS?. The result of geometry optimization using CASPT2/aug‐cc‐pVTZ shows that theoretically determined geometric parameters and harmonic vibrational frequencies for the HCNS ground state X1Σ+(X1A′) are in agreement with previous studies. The ionization energies, the electron affinity energies, the adiabatic excitation energies, and vertical excitation energies have been calculated and the corresponding cation and anion states are identified. By calculating adiabatic electron affinity, the states of HCNS? have been identified to contain both π orbital states (X2A′ and 12A″) and dipole‐bond states (14A′ and 14A″). © 2012 Wiley Periodicals, Inc. 相似文献
165.
《Analytical letters》2012,45(10):709-720
Abstract The performance of a liquid-membrane electrode using a synthetic, neutral carrier in o-nitro-phenyl-n-octyl-ether as membrane component in a PVC matrix, in the presence of sodium tetra-phenyl-borate, is described. Selectivities, working range, lifetime and anion interference are discussed. The electrode makes possible the measurement of calcium ion activities in the range 10?1M to 10?6M in unbuffered and in the range 10?1M to 10?8M in calcium buffered systems respectively. The selectivities of calcium over protons, magnesium, sodium and zinc are 25,000, 26,000, 2,800 and 7,100, respectively, and are far superior than those reported for other calcium sensors. 相似文献
166.
167.
大体积直接进样离子色谱法测定饮用水中 9种卤代乙酸和6种阴离子 总被引:25,自引:0,他引:25
建立了一种采用大体积直接进样离子色谱测定饮用水中9种卤代乙酸和6种阴离子的新方法。采用高容量的IonPac AS9HC阴离子色谱柱,在进样量为500 μL时,以28 mmol/L Na2CO3为淋洗液,采用流速梯度洗脱,可在35 min内同时测定上述15种被测物。对9种卤代乙酸的检测限为1.91-49.98 μg/L,其中对二氯乙酸、三氯乙酸的检测限分别为4.62和5.11 μg/L。应用该方法对北京市9个自来水厂的源水及出厂水中的卤代乙酸进行了测定。结果表明,所测水样中仅含有二氯乙酸和三氯乙酸,其他卤代 相似文献
168.
169.
通过键合不同数量的H2PO4^-离子构造了H4P2O8^2-和H4P4O16^8-两种阴离子集 团。利用密度泛函理论对它们的构型进行优化并计算其振动频率和喇曼散射效率。 测量了固—液界面边界层的喇曼光谱并与理论计算结果进行对比分析,进一步研究 了阴离子集团的结构、聚合及脱水等过程。实验和理论研究均表明阴离子二聚体是 KDP晶体的生长基元,他们在固液界面将进一步形成多聚体分子集团,而离子集团 的脱水过程则发生在距KDP晶体表面约50μm的固—液界面边界层中。随着生长层向 界面的推进,这些分子集团将变得越来越有序。本文的研究结果对确定晶体生长界 面动力学过程、发展和完善晶体生长理论有重要意义。 相似文献
170.
An ion-pair compound,[HL]2[Ni(CN)4]·4H2O 1 has been obtained as an unexpected product when we attempt to prepare a heterometallic cyano-bridged complex by the reaction of GdCl3·nH2O,K2Ni(CN)4 and L (L=4-(2-hydroxyphenyl)-1,5,9-triazacyclododecan-2-one) in aqueous solution,and characterized by single-crystal X-ray diffraction.It crystallizes in monoclinic,space group P21/n with a=12.380(1),b=9.9637(8),c=17.087(1)A,β=105.947(2)°,V=2026.6(3) A3,Rint=0.0509,Z=2,Dc=1.297g/cm3,C34H56O8N10Ni,Mr=791.60,F(000)=844,μ(MoKα)=0.538 mm-1,S=1.030,the final R=0.0644 and wR=0.1299 for 2023 observed reflections with I≥2σ(I).The title compound 1 contains one anion of [Ni(CN)4]2-,two cations of [HL]+and four packing water molecules,which are held together by the N-H…O and O-H…O hydrogen bonds to form a three-dimensional framework. 相似文献