全文获取类型
收费全文 | 201篇 |
免费 | 9篇 |
国内免费 | 54篇 |
专业分类
化学 | 259篇 |
晶体学 | 3篇 |
物理学 | 2篇 |
出版年
2023年 | 6篇 |
2022年 | 8篇 |
2021年 | 11篇 |
2020年 | 14篇 |
2019年 | 9篇 |
2018年 | 9篇 |
2017年 | 8篇 |
2016年 | 15篇 |
2015年 | 7篇 |
2014年 | 7篇 |
2013年 | 36篇 |
2012年 | 8篇 |
2011年 | 8篇 |
2010年 | 12篇 |
2009年 | 5篇 |
2008年 | 13篇 |
2007年 | 14篇 |
2006年 | 16篇 |
2005年 | 7篇 |
2004年 | 11篇 |
2003年 | 10篇 |
2002年 | 6篇 |
2001年 | 5篇 |
2000年 | 4篇 |
1999年 | 2篇 |
1998年 | 3篇 |
1997年 | 3篇 |
1996年 | 2篇 |
1995年 | 1篇 |
1994年 | 1篇 |
1993年 | 1篇 |
1992年 | 2篇 |
排序方式: 共有264条查询结果,搜索用时 15 毫秒
41.
Evan A. Sarina Marilyn M. Olmstead Divya Kanichar Michael P. Groziak 《Acta Crystallographica. Section C, Structural Chemistry》2015,71(12):1085-1088
2‐Acylated 2,3,1‐benzodiazaborines can display unusual structures and reactivities. The crystal structure analysis of the boron heterocycle obtained by condensing 2‐formylphenylboronic acid and picolinohydrazide reveals it to be an N→B‐chelated zwitterionic tetracycle (systematic name: 1‐hydroxy‐11‐oxo‐9,10,17λ5‐triaza‐1λ4‐boratetracyclo[8.7.0.02,7.012,17]heptadeca‐3,5,7,12,14,16‐hexaen‐17‐ylium‐1‐uide), C13H10BN3O2, produced by the intramolecular addition of the Lewis basic picolinoyl N atom of 1‐hydroxy‐2‐(pyridin‐2‐ylcarbonyl)benzo[d][1,2,3]diazaborinine to the boron heterocycle B atom acting as a Lewis acid. Neither of the other two pyridinylcarbonyl isomers (viz. nicotinoyl and isonicotinoyl) are able to adopt such a structure for geometric reasons. A favored yet reversible chelation equilibrium provides an explanation for the slow D2O exchange observed for the OH resonance in the 1H NMR spectrum, as well as for its unusual upfield chemical shift. Deuterium exchange may take place solely in the minor open (unchelated) species present in solution. 相似文献
42.
Bao‐Hua Zhang Lan‐xiang Shi Si‐Jie Liu Rui‐Xia Guo 《Journal of heterocyclic chemistry》2015,52(4):1234-1239
An efficient copper‐catalyzed N‐arylation reactions of imidazole, indole, and triazole with aryl or heteroaryl halides using cyclen derivatives as efficient organic base and ligand at moderate temperature have been investigated. The cross‐couplings proceed smoothly with good to excellent yields. 相似文献
43.
利用多组分1,3偶极环加成反应方法,合成了一种新的螺环结构1'-甲基-3'-吡啶甲酰基-4'-(2-噻吩基)螺[吲哚啉-3,2'-吡咯啉]-2-酮化合物,并对该化合物进行了红外光谱、核磁共振谱及X-射线单晶衍射表征.单晶衍射结果表明:该晶体属于三斜晶系,空间群为P-1,晶体参数为a=0.899 9(1)nm,b=0.914 4(1)nm,c=1.271 1(2)nm,α=92.852(1)°,β=107.305(2)°,γ=101.580(1)°.在分子晶体结构中,吡咯啉环采用了信封式构象,通过螺碳原子与吲哚啉环相连,形成刚性螺环结构,2个环接近垂直构型,其二面角为84.15(2)°. 相似文献
44.
Organolanthanide catalyzed cyclization-silylation of nitrogen-containing polyunsaturated systems allows access to core structures commonly found in naturally occurring alkaloids. Nitrogen-containing dienes with various substitution patterns were investigated. The method was most successful for substrates with terminal alkenes. Cyclization upon pendant 1,1-disubstituted olefins was not realized under various conditions. Interestingly, sterically hindered sulfonamides, which were previously believed to render the catalyst inactive, were actually compatible with the catalyst, thus affording the cyclized products after prolonged reaction times. Variations using fused ring systems were also investigated. 相似文献
45.
Ivan Gospodinov Johannes Singer Thomas M. Klaptke Jrg Stierstorfer 《无机化学与普通化学杂志》2019,645(21):1247-1254
In the present studies, the synthesis of new energetic materials based on the pyridazine scaffold and their characterization is the main subject. For this purpose, desired 3,5‐dimethoxy‐4,6‐dinitropyridazine‐1‐oxide ( 7 ) was synthesized in the first instance. The persubstituted pyridazine precursor laid the groundwork for further preparative modification. The targeted functionalization through the regioselective introduction of various smaller amine nucleophiles such as methylamine or 2‐aminoethanol gave several new energetic materials. Among them are 3,5‐bis(methylamino)‐4,6‐dinitropyridazine‐1‐oxide ( 8 ), 3,5‐bis(methylnitramino)‐4,6‐dinitropyridazine‐1‐oxide ( 9 ), 3,5‐bis(dimethylamino)‐4,6‐dinitropyridazine‐1‐oxide ( 10 ), and 3,5‐bis((2‐hydroxyethyl)amino)‐4,6‐dinitropyridazine‐1‐oxide ( 11 ). With the aim of increasing the detonation performance, compound 8 was additionally nitrated and 3,5‐bis(methylnitramino)‐4,6‐dinitropyridazine‐1‐oxide ( 9 ) was obtained. These new energetic materials were characterized and identified by multinuclear NMR (1H, 13C, 14N, 15N) and IR spectroscopy, elemental analysis and mass spectrometry. In addition, their sensitivities toward impact, friction and electrostatic discharge were thoroughly examined. Furthermore, obtained single‐crystals of the substances were characterized by low‐temperature single‐crystal X‐ray diffraction. 相似文献
46.
Corina Cheptea Valeriu Sunel Shardi Manahedji Ardeshir Ana Cezarina Morosanu 《Molecular Crystals and Liquid Crystals》2020,697(1):97-107
AbstractDipeptide derivatives from p-aminobenzoyl-phenylglycine and p-aminobenzoyl-phenylalanine were grafted on 1,2,4-triazole heterocycle in order to get new substances with potential biological activity. The compounds synthetized and characterized in this paper have a structure that fits in the antimetabolites category, products used to treat malignant tumors. The presence of several bioactive groups in the same molecule permits us to study the chemical structure - biological activity correlation based on computational analyses using SPARTAN’14 software. Some correlations between the molecular parameters established with Spartan’14 software are evidenced in this paper. 相似文献
47.
William?H.?WatsonEmail author Tao?Chen Michael?G.?RichmondEmail author 《Journal of chemical crystallography》2004,34(11):765-771
Refluxing 2,3-dichloromaleic anhydride with p-anisidine in benzene with water removal gives the condensation product 2,3-dichloro-N-(p-MeOC6H4)maleimide (1) 75% yield. This new maleimide compound reacts with added ethanethiol in the presence of Et3N or DBU to furnish the bidentate sulfide ligand 2,3-bis(ethylthio)-N-(p-MeOC6H4)maleimide (2) in 85% yield. Each product has been characterized in solution by IR, NMR, and UV-vis spectroscopies, and the solid-state structure of 2,3-bis(ethylthio)-N-(p-MeOC6H4)maleimide was unequivocally established by single-crystal X-ray diffraction analysis. 2,3-bis(Ethylthio)-N-(p-MeOC6H4)maleimide crystallizes in the monoclinic space group C2/c, a = 20.035(3)Å, b = 9.188(1)Å, c = 16.887(2)Å, = 93.696(2)°, V = 3102.3(8)Å3, Z = 8, and Dcalcd = 1.385 mg/m3; R = 0.0268, Rw = 0.0676 for 2025 reflections with I > 2 (I). The nature of the LUMO in 2,3-bis(ethylthio)-N-(p-MeOC6H4)maleimide (2) has been determined by extended Hückel molecular orbital calculations, and these data are discussed relative to the cyclic voltammetry results and other structurally relevant compounds prepared in our labs. 相似文献
48.
49.
Stephan Schrölkamp Alfons Völkl Thomas Lügger F. Ekkehardt Hahn Wolfgang Beck Wolf Peter Fehlhammer Prof. Dr. 《无机化学与普通化学杂志》2008,634(15):2940-2947
Palladium, Platinum, and Diiron Complexes with Isocyanoacetate: Ring Closure, Acid‐Induced Ring Opening, Diprotonation Substitution by isocyanoacetate (CNCH2CO2?) of one chloro ligand in trans‐[MCl2(PPh3)2] (M = Pd, Pt) results in the Δ2‐oxazolin‐5‐on‐2‐ato complexes 4a , b , i.e. immediate cyclization occurs in contact with these metal(II) species. In contrast, the open‐chain form of the functional isocyanide is retained in [K(18‐crown‐6][Fe2Cp2(CNCH2CO2)(CO)3] ( 16 ) in which it occupies a terminal position. Protonation (alkylation) of the platinum complex 4b proceeds with ring cleavage and formation of isocyano acetic acid 11 (ethyl isocyanoacetate 12 ) stabilized by metal ion coordination. Protonation of 16 requires two equivalents of acid to yield the aminocarbyne‐bridged complex [{μ‐C=N(H)CH2CO2H}Fe2Cp2(CO)3](BF4) ( 17 ) as the only isolable product. Here isocyanoacetate displays a third kind of reactivity pattern in addition to that at PdII/PtII and that at Cr0/W0 where the primary species [M(CO)5CNCH2CO2]? and [M(CO)5CNCH2CO2H] proved to be the most stable. All of the proposed structures are substantiated by analytical and the usual spectroscopic (IR, NMR{1H, 13C, 31P}, FAB‐MS) data, that of 4b also by an X‐ray structure determination which reveals a practically perpendicular arrangement of the coordination and the ring plane, and a long C2‐O bond as the predetermined breaking point of the heterocycle. 相似文献
50.