The crystal and molecular structure of lithium tert-butoxide and the markedly improved structure analysis of sodium tert-butoxide are reported. LiO'Bu (1) crystallizes in form of hexameric units (1)(6) the monoclinic space group C2/m with a = 2953.5, b = 1752.1, c = 1008.9 pm, beta =...
structure (organic substancesA solution of LiCl prepared in basic melt (54 mol% AlCl 3 , 55 mol% butylpyridinium Chloride) reacts with weighted amounts of the cryptand C222B (= L) to yield the title Complex (I), which crystallizes in the space group P2 1 /n with Z=4.doi:10.1002/...
structure (organic substancesNo abstract is available for this article.doi:10.1002/chin.198114069T. J. LYNCHM. NEWCOMBD. E. BERGBREITERM. B. HALLWILEY‐VCH Verlag GmbHCheminformLynch T.J,Newcomb M,Bergbreiter D.E,Hall M.B.Molecular structure of the lithium enolate of acetaldehydes. ...
In order to predict the binding interactions between the active site of the tubulin complexed with colchicine as a reference ligand, molecular docking was performed between the compound 13a, into the crystal structure of the tubulin complex with PDB ID: 1SA0 using Maestro 8.5 (Schrodingers LLC, ...
Structure of crystalline (hexatriene dianion)dilithium, an ion-paired Z,Z-dianion The reaction of tetrakis(trimethylsilyl)- (or cis-diphenyl) cyclobutadiene cobalt complexes with lithium metal in THF at room temperature produced the dili... Satish,K.,Arora,... - 《Journal of the American Chemi...
In this paper, the influence of lithium, sodium, potassium, rubidium and cesium on the electronic system of the 3-nitrobenzoic acid was studied. The vibrational (FT-IR, FT-Raman) and NMR (1H and 13C) spectra for 3-nitrobenzoic acid and its alkali metal salts were recorded. The changes ...
The electronic structure of intercalated with lithium is analysed within a molecular approach that uses a finite-size cluster to represent the solid. Electronic descriptors such as the electronic chemical potential, bond order and the density of states are used to discuss the bonding properties and ...
(1)weresynthesizedviaacyclictetramerizationofthecorrespondingopticallyactivebenzo[6]dinaphtho[2,1一P:1’,2'-g][1,4]dioxocine一5,6一dicarbonitrile(2)inrefluxing一pentanolinthepresenceoflithiumfol—lowedbytreatmentwithaceticacid.Thisnove1chiralphtha1ocvaninecompoundhasbeencharacterizedbyaseriesofspec—tro...
Our MD simulations show that among the four structures we constructed for Li2S8 nanoparticles, the core-shell structure is the most thermodynamically stable one during the charging (delithiation) process. In contrast to bulk crystal Li2S, we find the presence of mixed lithium sulfide and poly...
We attempted to differentiate BD from control participants based on brain structure. In addition, we studied the effects of different data handling strategies on classification performance, described the neuroanatomical features, which contributed to individual subject classification and investigated the ...