共查询到20条相似文献,搜索用时 15 毫秒
1.
Kalagouda B. Gudasi Ramesh S. Vadavi Rashmi V. Shenoy Siddappa A. Patil Munirathinam Nethaji 《Transition Metal Chemistry》2006,31(1):135-145
The synthesis of a new ligand 2-pyridine-2-yl-3(pyridine-2-carboxylideneamino)-quinazolin-4(3H)-one (PPCAQ) is described together
with its manganese(II), cobalt(II), nickel(II), copper(II), zinc(II) and cadmium(II) complexes. The single crystal X-ray diffraction
studies of the ligand reveal the presence of two crystallographically independent molecules in asymmetric unit cell, which
exhibit N…N attractive interaction. The PPCAQ and its metal complexes were characterized by analytical, spectroscopic (i.r.,
n.m.r and u.v.–vis), magnetic moment, conductance and thermal studies. The i.r. spectral studies reveal the ligational diversity
of the PPCAQ towards different metal ions as NNN donor in cobalt(II), copper(II), zinc(II) and cadmium(II) complexes and as
ONN donor in manganese(II) and nickel(II) complexes. The antimicrobial activity of all the compounds was tested; copper(II),
zinc(II) and cadmium(II) complexes show enhanced antibacterial activity compared to the free ligand. 相似文献
2.
Kalagouda B. Gudasi Siddappa A. Patil Ramesh S. Vadavi Rashmi V. Shenoy Munirathinam Nethaji 《Transition Metal Chemistry》2006,31(5):586-592
A new 1,2-dihydroquinazolin-4(3H)-one ligand, 2-[2-hydroxy-3-methoxyphenyl]-3-[2-hydroxy-3-methoxybenzylamino]-1,2-dihydroquinazolin-4(3H)-one
(Hmpbaq), formed by the condensation of 2-aminobenzoylhydrazide with 2-hydroxy-3-methoxybenzaldehyde and its copper(II), nickel(II),
cobalt(II), manganese(II), zinc(II) and cadmium(II) complexes, have been synthesized. Their structures have been elucidated
on the basis of elemental analyses, conductance measurements, magnetic moments, spectral (i.r., 1H-n.m.r., u.v.–vis., e.p.r. and FAB-mass) and thermal studies. The formation of 1,2-dihydroquinazolin-4(3H)-one rather than
hydrazone in the reaction of 2-aminobenzoylhydrazide with 2-hydroxy-3-methoxybenzaldehyde is confirmed by the 1H-n.m.r. spectra and single crystal X-ray diffraction studies. The tridentate behavior of the ligand was proposed on the basis
of spectral studies. X-band e.p.r. spectra of the copper(II) and manganese(II) complexes in the polycrystalline state at room
temperature and liquid nitrogen temperature were recorded and their salient features are reported. Thermal stabilities of
the manganese(II) and zinc(II) complexes have been studied. 相似文献
3.
The synthesis of cobalt(II), nickel(II) and zinc(II) complexes of 2-pyridine-2-yl-3(pyridine-2-carboxylideneamino)-1,2-dihydroquinazolin-4(3H)-one is described. The ligand and metal complexes were characterized by elemental analysis, conductivity measurements, spectral (u.v.–vis., i.r., 1D n.m.r., 2D hetcor and mass) and thermal studies. The cobalt(II) complex crystallizes as pink crystals in the monoclinic crystal system, space group P21/n with a = 10.066(6) Å, b = 15.929(9) Å, c = 12.624(7) Å, α = 90.00(9)°, β = 110.850 (8)°, γ = 90.00, V = 1891.5 (18) Å3 and Z = 4. The geometry around the cobalt atom is distorted trigonal bipyramidal with τ = 0.83 [structural parameter, τ = (β − α)/60; where α and β are the two basal angles in a five coordinate complex]. 相似文献
4.
本文报道了一类基于 2-(4-苯基-1,2,3-三唑)亚甲基吡啶(PTMP)配体的过渡金属镍、钴和锌配合物的合成,并通过单晶衍射实验确定了它们的晶体结构。研究结果表明,在这类金属配合物中,PTMP 均通过吡啶氮原子和 1,2,3-三唑中的 2 位氮原子与金属配位,并形成了六元螯合环。在 Co髤及 Ni髤的配合物中,有 2 个 PTMP 参与配位,配位数为 6,配合物的空间构型是畸变的八面体;而在 Zn髤中则只有 1 个 PTMP 参与配位,配位数为 4,配合物的空间构型是变形的四面体。晶体结构数据分析及理论计算结果表明,尽管 PTMP 分子中 1,2,3-三唑环上的 2 位氮原子相对于 3 位氮原子而言,电子云密度较低,但在这类配合物中由于"螯合效应"2 位氮原子仍然表现出了较强的配位能力。 相似文献
5.
3-苯基喹唑啉-4(3H)-酮的合成及晶体结构 总被引:1,自引:0,他引:1
标题化合物C14H10ON2是由邻硝基苯甲酰苯胺与原甲酸三乙酯在低价钛试剂作用下反应而得。结构通过单晶X-射线衍射分析确定, 其晶体属于单斜晶系, 空间群P21/c, a = 12.080(2), b = 7.793(1), c = 11.599(1) ? b = 97.56(1), Mr = 222.24, V = 1082.4(2) ?, Dc = 1.364 g/cm3, Z = 4, m(MoKa) = 0.88 mm-1, F(000) = 464, R = 0.0385, wR = 0.0851。X-衍射分析表明: 平面I (C(1)~C(6))与平面II (C(9)~C(14))之间的夹角为124.38; 平面I与平面III (ON(1)?N(2)C(7)C(8)C(9)C(14))之间的两面角为125.47; 平面II与平面III之间的两面角为2.76。 相似文献
6.
《结构化学》2020,(5)
The target compound(C_(19)H_(20)ClNO) was structurally determined by single-crystal X-ray diffraction. The crystal is in monoclinic system, space group P2_1/n with a = 9.2365(2), b = 12.1241(3), c = 14.9960(4) ?, β = 106.589(3)°, C_(19)H_(20)ClNO, M_r = 313.81, D_c = 1.295 g/cm~3, V = 1609.42(7) ?~3, Z = 4, F(000) = 664, μ(MoKa) = 2.097 mm~(-1), T = 200(10) K, 2813 independent reflections with 2533 observed ones(I 2σ(I)), R = 0.0389 and wR = 0.1057 with GOF = 1.043(R = 0.0423 and wR = 0.1083 for all data). The 3,4-dihydroquinolin-2(1 H)-one moiety maintains thermodynamically stable trans configuration. The decomposition mechanism of compound 3 is complex by thermal analysis. 相似文献
7.
Reaction of isatoic anhydride with aniline derivatives gave 2-amino-N-(aryl)benzamides.The latters reacted with phenyli-sothiocyanate in the presence of heteropolyacids in various solvents which afforded 3-(aryl)-2-thioxo-2,3-dihydroquinazolin- 4(1H)-one derivatives.The effects of various heteropolyacids including Preyssler and Keggin on the yields and reaction times have been investigated. 相似文献
8.
Zora Popović Gordana Pavlović Željka Soldin Jasminka Popović Dubravka Matković-Čalogović Maša Rajić 《Structural chemistry》2002,13(5-6):415-424
The series of compounds of the general formulae HgX2(tzdtH) and HgX2(tzdtH)2 (X = Cl, Br, I; tzdtH = 1,3-thiazolidine-2-thione) have been prepared, as well as Hg(tzdt)2. IR, 1H, and 13C NMR spectral data of the complexes indicate thione donation, which is confirmed by the crystal structure analyses of [HgBr2(tzdtH)]2, [HgI2(tzdtH)]2, and HgI2(tzdtH)2. The structures of [HgBr2(tzdtH)]2 and [HgI2(tzdtH)]2 consist of centrosymmetric doubly bridged dimers, but they are not isostructural. The asymmetry in the HgX2Hg bridge is more pronounced in the bromo than in the iodo derivative [S–Hg–X(terminal) is 138.19(9)° for X = Br and 123.49(10)° for X = I], which is accompanied by the stronger Hg–S covalent bond in the bromo than in the iodo complex [2.435(4) vs. 2.510(3) Å]. The Hg–X(bridging) (X = Br, I) bond distances are shorter than the sum of van der Waals radii for mercury and X. Dimeric centrosymmetric complex units are held together only by van der Waals forces in [HgI2(tzdtH)]2, while in [HgBr2(tzdtH)]2 there is an intramolecular hydrogen bond of N–H Br type (3.34(1) Å). HgI2(tzdtH)2 exists as a mononuclear tetrahedral complex with two long Hg–S [2.672(1) Å] and two short Hg–I bond distances [2.688(1) Å] related by a twofold axis. The molecules of HgI2(tzdtH)2 are linked into infinite chains along the c axis by intermolecular N–H S [3.38(1) Å] hydrogen bonds. 相似文献
9.
Synthesis and Crystal Structure of 5-Methyl- 2-phenyl-4-[(2-p-bromophenylamino)-furylmethylene]-3(2H)-one 总被引:1,自引:1,他引:0
ZHANG Yong LI Jin-Zhou ZHANG Heng-Qiang 《结构化学》2008,27(5):519-522
A novel 4-heterocyclic acylpyrazolone-based Schiff base compound 5-methyl- 2-phenyl-4-[(2-p-bromophenylamino)-furylmethylene]-3(2H)-one (C21H16N3O2Br) has been synthesized by the reaction of 1-phenyl-3-methyl-4-(α-furoyl)-pyrazolone-5 (HPMαFP) and p-bromoaniline. Elemental analysis, IR spectra and X-ray single-crystal diffraction were carded out to determine the composition and crystal structure of the compound. Crystal data: triclinic system, space group P1^-, a = 9.0936(3), b = 9.8067(4), c = 11.6863(4) A, α = 102.512(10), β = 90.9630(10), γ = 114.327(10)°, Mr= 422.28, Z= 2, F(000) = 428.0, V= 920.46(11)A^3, Dc = 1.524 g/cm^3,μ = 2.254mm^-1, R = 0.0476 and wR = 0.1318 for 9389 independent reflections (Rint = 0.0122) and 3281 observed reflections (I 〉 2σ(I)). Structural analysis indicates that the compound exists in an amine-one form. 相似文献
10.
Synthesis, Crystal Structure and Antibacterial Activity of 1-((2-Chloroquinolin-3-yl)-methyl)-pyridin-2(1H)-one 总被引:1,自引:0,他引:1
S. Mohana Roopan Venkatesha R. Hathwar F. Nawaz Khan Atul Kumar Kushwaha 《结构化学》2010,29(11):1612-1617
On the basis of the interesting structures and biological activities exhibited by several heterocyclic systems possessing the pyridone nucleus such as mappcine and camptothecin, we have planed to design the synthesis, crystal studies and antibacterial activity of the new 1-((2- chloroquinolin-3yl)-methyl)-pyridine-2(1H)-one building block. An X-ray analysis has provided valuable insight into the effect of steric factors on the three-dimensional shape of this compound which serves as a useful advanced intermediate in the synthesis of these biologically active molecules. A multistep synthesis of camptothecin (5) has been designed by retrosynthetic analysis as part of an ongoing program on lead anticancer drug. 相似文献
11.
Moamen S. Refat Sulekh Chandra Monika Tyagi 《Phosphorus, sulfur, and silicon and the related elements》2013,188(1):22-33
Mn(II), Co(II), Ni(II), and Cu(II) complexes have been synthesized with benzil bis(thiosemicarbazone) (L) and characterized by elemental analyses, molar conductance measurements, magnetic susceptibility measurements, thermogravimetric studies, infrared (IR), electronic, and electron paramagnetic resonance (eEPR) spectral studies. The molar conductance measurements of the complexes in DMF correspond to the non-electrolytic nature of the complexes. Thus these complexes may be formulated as [M(L)X2] (where M = Mn(II), Co(II), Ni(II), Cu(II) and X = Cl? and NO3 ?). On the basis of IR, electronic, and EPR spectral studies, an octahedral geometry has been assigned for Mn(II), Co(II), and Ni(II) complexes, whereas a tetragonal geometry for the Cu(II) complexes is presumed. The free ligand and its metal complexes were tested against the phytopathogenic fungi (i.e., Rhizoctonia baticola, Alternaria alternata) in vitro. 相似文献
12.
Ayse ERCAG Sema Oztürk YILDIRIM Mehmet AKKURT Mahmure Ustün OZGUR Frank W. HEINEMANN 《中国化学快报》2006,(2)
Schiff bases of isatin were reported to possess antibacterial, antifungal, antiviral, anti-HIV, antiprotozoal, and anthelmintic activities1. They also exhibit significantanticonvulsant activity, apart from other pharmacological properties2. Conductingsubs… 相似文献
13.
3-Methyl-5-(2-methylphenyl)-1,3,4-oxadiazol-2(3H)-one(6) and N,N-diethyl-2-(2-methylbenzoyl)-hydrazinecarboxamide(7) were designed and synthesized from 5-(2-methylphenyl)-1,3,4-oxadiazol-2(3H)-one(5) by substituting and ring-opening, respectively. The target compounds were confirmed by IR, 1H NMR spectroscopy, MS, elemental analysis and single-crystal X-ray diffraction. Compound 6(C10H10N2O2, Mr = 190.20) crystallizes in the triclinic system, space group P 1 with a = 7.4645(16), b = 10.868(2), c = 12.970(3) A, α= 110.542(2), β= 98.142(2), γ=99.766(2)°, V = 947.7(3) A3, Z = 4, F(000) = 400, Dc = 1.333 g/cm3, μ= 0.095 mm-1, the final R =0.0550 and wR = 0.1483 for 2956 observed reflections with I 2γ(I). Compound 7(C13H19N3O2, Mr= 249.31) crystallizes in the monoclinic system, space group C2/c with a = 18.926(3), b =12.1853(17), c = 14.740(2) o,(I) = 125.6380(10)°, V = 2762.7(7) A3, Z = 8, F(000) = 1072, Dc=1.199 g/cm3, μ= 0.083 mm-1, the final R = 0.0554 and w R = 0.1468 for 2395 observed reflections with I 2σ(I). The preliminary bioassay results indicate that compound 6 exhibits notable fungicidal activities against Fusarium graminearum, Botrytis cinerea, Rhizoctonia cerealis and Colletotrichum capsici at the concentration of 100 μg/mL. 相似文献
14.
15.
16.
YU Chen-Xia ZHU Xiao-Tong YAO Chang-Sheng TU Shu-Jiang 《结构化学》2007,26(5):533-536
The title compound (C16H14BrNO) has been synthesized by the reaction of p-tolylamine, Meldrum’s acid and 4-bromo-benzaldehyde, and its structure was characterized by IR, 1H NMR and X-ray single-crystal diffraction. The crystal belongs to monoclinic, space group P21/n with a = 7.6850(11), b = 8.3004(11), c = 21.301(3) , β = 95.110(2)°, V = 1353.4(3) 3, Mr = 316.19, Z = 4, Dc = 1.552 g/cm3, μ(MoKα) = 3.028 mm-1, F(000) = 640, the final R = 0.0345 and wR = 0.0768. X-ray analysis reveals that the atoms of C(1), C(2), C(3), C(4), C(5) and N(1) form a six-membered ring of boat conformation. 相似文献
17.
ZHANG Gai LIANG Yong-Qing ZHANG Rong-Lan ZHANG Wei-Hai ZHAO Jian-She GUO Zhi-An 《结构化学》2005,24(7):783-789
A new quinazolinone compound 2,3-dihydro-2-(2-hydroxyphenyl)-3-phenylquinazolin-4(IH)-one 3 ([C2oH16O2N2]-C2H5OH, Mr = 362.42) and compound 2-(2-hydroxybenzylidene-amino)-N-phenyl-benzamide 2 (C2oH16O2N2, Mr = 316.34) were prepared from a precursor of 2-amino-N-phenyl-benzamide 1 (C13H12ON2, Mr = 212.25). Compound 3 was characterized by single-crystal X-ray diffraction analysis. The crystal belongs to orthorhombic,space group Pbca with a = 1.2889(11), b = 1.6170(14), c = 1.7729(15) nm, V= 3.695(6) nm^3, Z= 8, F(000) = 1536, Mr = 362.42, Dc = 1.303 g/cm^3, μ(MoKa) = 0.087 mm^-1, R = 0.0447 and wR= 0.0879. The crystal structure analysis indicates that the title compound has a two-dimensional network structure formed by hydrogen bonds and electrostatic interactions. 相似文献
18.
1 INTRODUCTION Biginelli reaction is a three-component condensa-tion of ethyl acetoacetate, benzaldehyde and urea forthe synthesis of 3,4-dihydropyrimidin-2(1H)-ones(Scheme 1). The reaction can be carried out in aone-pot fashion in alcohol solution in t… 相似文献
19.
单质碘与三苯基膦促进的对氯苯亚磺酸钠与1,3-二对甲苯基丙炔-1-醇的自由基加成-分子内氧化碳氢键环化的多步骤串联反应,以70%的产率得到化合物5-甲基-3-对甲苯基-2-对氯苯硫基-1H-茚酮。化合物经1H NMR、13C NMR、 IR和HR-MS等表征,其结构经X-射线单晶衍射分析确证。晶体属于三斜晶系,空间群P-1,晶细胞参数:a=10.7305(7)?,b=13.0234(8)?,c=14.7071(9)?,α=105.289(3)°,β=101.273(3)°,γ=98.623(3)°,V=1899.7(2)?3,Z=4, Dc=1.318 mg/m3,μ=0.320 mm-1,F(000)=784。结构偏离因子R1=0.0705, wR2=0.1903,共收集到8687个独立衍射点,其中I>2σ(I)的可观测点为5542个。 相似文献
20.
ZONG Guang-Ning LI Feng-Yun FAN Zhi-Jin MAO Wu-Tao SONG Hai-Bin CHEN Lai ZHU Yu-Jie 《结构化学》2015,34(6)
The title compound diethyl 2-(3,4-dichloroisothiazol-5-yl)-4-(trifluoromethyl)-4,5-dihydrothiazol-4-yl-3-methylbenzoate(C15H9Cl2F3N2O2S2, Mr = 441.26) was prepared from methyl 3,4-dichloroisothiazole-5-carboxylate as the starting material by four steps of reaction. Its structure was characterized by IR, 1H-NMR, 13C-NMR, EA and single-crystal X-ray diffraction. The crystal of the title compound belongs to the monoclinic system, space group P21/c with a = 8.8437(18), b = 16.128(3), c = 12.305(3), β = 91.68(3)o, V = 1754.4(6) 3, Z = 4, Dc = 1.671 g/cm3, μ(Mo Ka) = 0.71073 mm-1, F(000) = 888, R = 0.0384 and w R = 0.0778. Weak π-π interactions occur between the isothiazole rings and phenyl rings of adjacent molecules to form a one-dimensional chain and stabilize the crystal structure. Bioassay indicates that the title compound has good activity against the fungi and TMV tested. 相似文献