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Cationic guests in extended anionic C-methylcalix[4]resorcinarene-inorganic frameworks 扩展阴离子c -甲基杯[4]间苯二甲酸-无机骨架中的阳离子客体
Pub Date : 2002-08-01 DOI: 10.1016/S1472-7862(03)00066-2
P. O. Brown, G. Enright, J. Ripmeester
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引用次数: 15
Stabilization of guest-free forms of metal dibenzoylmethanate host type through self-inclusion of a ligand fragment into the intramolecular pocket 通过将配体片段自包裹入分子内袋,稳定无客体形式的金属二苯甲酰甲烷寄主类型
Pub Date : 2002-08-01 DOI: 10.1016/S1472-7862(03)00055-8
D. Soldatov, G. Enright, A. S. Zanina, I. E. Sokolov
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引用次数: 10
Inclusion Properties of a Chlorinated Diquinoline Host 氯化二喹啉寄主的包合性质
Pub Date : 2002-08-01 DOI: 10.1016/S1472-7862(03)00050-9
A. Rahman, R. Bishop, D. Craig, M. Scudder
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引用次数: 6
Phase Diagrams of the Ternary Gas Hydrate Forming Systems at High Pressures. Part 1. Propane–Methane–Water System 高压下三元气体水合物形成体系的相图。第1部分。Propane-Methane-Water系统
Pub Date : 2002-08-01 DOI: 10.1016/S1472-7862(03)00061-3
E. Aladko, Y. A. Dyadin, A. Manakov, F. V. Zhurko, E. G. Larionov
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引用次数: 8
X-ray and 2H NMR studies of structure and dynamics in the Hofmann-type and the Hofmann-(en)-type pyrrole clathrates Hofmann型和Hofmann-(en)型吡咯包合物的x射线和2H核磁共振结构和动力学研究
Pub Date : 2002-08-01 DOI: 10.1016/S1472-7862(03)00067-4
S. Nishikiori, Akiji Takahashi, C. Ratcliffe, J. Ripmeester
{"title":"X-ray and 2H NMR studies of structure and dynamics in the Hofmann-type and the Hofmann-(en)-type pyrrole clathrates","authors":"S. Nishikiori, Akiji Takahashi, C. Ratcliffe, J. Ripmeester","doi":"10.1016/S1472-7862(03)00067-4","DOIUrl":"https://doi.org/10.1016/S1472-7862(03)00067-4","url":null,"abstract":"","PeriodicalId":100833,"journal":{"name":"Journal of Supramolecular Chemistry","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2002-08-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"90994246","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 12
Layer and chain structures in the co-Crystals of 18-Crown-6 with aromatic thiosemicarbazide derivatives 18-冠-6与芳香硫代氨基脲衍生物共晶的层状和链状结构
Pub Date : 2002-08-01 DOI: 10.1016/S1472-7862(03)00051-0
Y. Simonov, M. Fonari, J. Lipkowski, E. Ganin, A. Yavolovskii
{"title":"Layer and chain structures in the co-Crystals of 18-Crown-6 with aromatic thiosemicarbazide derivatives","authors":"Y. Simonov, M. Fonari, J. Lipkowski, E. Ganin, A. Yavolovskii","doi":"10.1016/S1472-7862(03)00051-0","DOIUrl":"https://doi.org/10.1016/S1472-7862(03)00051-0","url":null,"abstract":"","PeriodicalId":100833,"journal":{"name":"Journal of Supramolecular Chemistry","volume":null,"pages":null},"PeriodicalIF":0.0,"publicationDate":"2002-08-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"87752665","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 4
Novel layer- and channel-type anionic host lattices built of thiourea, 2-thiouracil anion and water 由硫脲、2-硫脲嘧啶阴离子和水组成的新型层状和通道型阴离子主晶格
Pub Date : 2002-08-01 DOI: 10.1016/S1472-7862(03)00069-8
Qi Li, Hai-yan Hu, C. Lam, T. Mak
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引用次数: 8
Absolute Stability Boundaries of Clathrate Hydrates of Cubic Structure II 立方结构包合物水合物的绝对稳定边界Ⅱ
Pub Date : 2002-08-01 DOI: 10.1016/S1472-7862(03)00062-5
Vladimir R Belosludov , Talgat M Inerbaev , Rodion V Belosludov , Jun-ichi Kudoh , Yoshiyuki Kawazoe

Stability of argon, krypton and propane clathrate hydrates of cubic structure II (CS-II) and of empty CS-II hydrate lattice has been investigated in a wide range of temperatures and pressures up to boundaries of absolute stability. The boundaries of mechanical stability in the framework of lattice dynamics method are determined in the quasiharmonic approximation from the Born stability conditions of crystal lattice. It has been shown by comparison of chemical potentials for empty hydrate lattices of structures I and II and ice Ih that at positive pressures empty hydrate lattices are thermodynamically metastable regarding to the ice Ih. At negative pressures there exist equilibrium lines between these phases. It has been found that despite weakness of the guest–host interactions, the guest molecules stabilize metastable host framework and the boundaries of stability depend on the type of the guest molecule. Moreover, in the cases of argon and krypton hydrates, the effect of double occupancy of the large cage on stability of CS-II structure has been also examined.

研究了立方结构II(CS-II)和空CS-II水合物晶格的氩、氪和丙烷包合物水合物在高达绝对稳定性边界的宽温度和压力范围内的稳定性。在晶格动力学方法的框架下,从晶格的玻恩稳定性条件出发,在准调和近似下确定了力学稳定性的边界。通过比较结构I和II的空水合物晶格与冰Ih的化学势已经表明,在正压力下,空水合物晶格相对于冰Ih在热力学上是亚稳的。在负压下,这些相之间存在平衡线。研究发现,尽管客体-宿主相互作用较弱,但客体分子稳定了亚稳态宿主框架,稳定性的边界取决于客体分子的类型。此外,在氩和氪水合物的情况下,还考察了大笼的双重占据对CS-II结构稳定性的影响。
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引用次数: 5
Water-fluorine chains in (n-Bu)4NF·5.5H2O hydrate (n-Bu)4NF·5.5H2O水合物中的水氟链
Pub Date : 2002-08-01 DOI: 10.1016/S1472-7862(03)00056-X
Konstantin A Udachin , Janusz Lipkowski

The structure and composition of (n-Bu)4NF·5.5H2O hydrate were determined from single crystal X-ray diffraction data at 173 K. It is monoclinic C2/c with cell parameters a=16.590(3), b=17.040(3), c=16.510(3) Å, β=103.18(3)°. Water molecules and fluorine ions connected by hydrogen bonds form cages consisting of two square faces and four pentagonal faces. These cavities are connected to each other, forming an infinite chain parallel to the c axis of the crystal.

由173K下的单晶X射线衍射数据确定了(n-Bu)4NF·5.5H2O水合物的结构和组成。它是单斜的C2/c,晶胞参数为a=16.590(3),b=17.040(3)、c=16.510(3)Å,β=103.18(3)°。水分子和氟离子通过氢键连接形成由两个正方形面和四个五边形面组成的笼。这些空腔相互连接,形成一条平行于晶体c轴的无限链。
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引用次数: 6
Diversity of the Supramolecular Association Modes Between the Dicarboxylic Host Compound 1,1′-Binaphthyl-2,2′-dicarboxylic Acid and the First Five Representatives of the Homologous Series of Aliphatic Monocarboxylic Acids as Guests 二元主体化合物1,1′-二萘甲基-2,2′-二羧酸与脂肪族一元羧酸同源系列前五个代表作为客体的超分子缔合模式的多样性
Pub Date : 2002-08-01 DOI: 10.1016/S1472-7862(03)00057-1
Bakhtiyar T Ibragimov , Kayrat M Beketov , Edwin Weber

The solved structures of clathrates between 1,1′-binaphthyl-2,2′-dicarboxylic acid (BNDA) as host and acetic, propionic and butyric acid guests together with previously determined clathrates of BNDA with formic and acetic acid testify that each of the first four representatives of the homologous series of aliphatic monocarboxylic acids has its own association mode with the dicarboxylic host. Acetic acid forms a clathrate specific for it at room temperature and gives a solvate isostructural with the propionic acid inclusion complex at 60 °C. The host–guest complex of butyric acid is isostructural with the clathrate of valeric acid. As a matter of principle, it is shown that (1) the larger the monocarboxylic acid molecule the greater is its ability to disintegrate infinite chains of H-bonded host molecules characteristic for a guest-free host compound—formic acid is not able to cut host chains to smaller fragments and attaches itself to them, acetic acid tends to cut chains to dimers which are then associated to circular tetramers through H-bonds of guest molecules, propionic acid disintegrates host chains to linear tetramers while butyric as well as valeric acid cut the chains to dimeric units. (2) The higher the crystallization temperature of the dicarboxylic host from solutions in acetic acid the stronger is the interaction between the host molecules in the obtained crystal modification.

1,1′-联萘-2,2′-二羧酸(BNDA)作为主体与乙酸、丙酸和丁酸客体之间的包合物的求解结构,以及先前确定的BNDA与甲酸和乙酸的包合产物,证明了脂肪族一元羧酸同源系列的前四个代表物中的每一个都与二羧酸主体有自己的缔合模式。乙酸在室温下形成特定的包合物,并在60°C下与丙酸包合物形成溶剂合物。丁酸的主客体复合物与戊酸的包合物是同构的。原则上,研究表明:(1)一元羧酸分子越大,其分解无限链氢键宿主分子的能力就越强,这是无客体宿主化合物的特征——甲酸不能将宿主链切割成更小的片段并附着在它们上,乙酸倾向于将链切割成二聚体,然后通过客体分子的氢键与环状四聚体结合,丙酸将主链分解成线性四聚体,而丁酸和戊酸将链切割为二聚体单元。(2) 二羧酸主体从乙酸溶液中结晶的温度越高,在所获得的晶体改性中主体分子之间的相互作用就越强。
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引用次数: 5
期刊
Journal of Supramolecular Chemistry
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