The results show that the δ-Al2O3 phase contains three distinct AlO sites and three distinct AlT sites. This detailed Al site structural information offers a powerful way of analyzing the most complex γ-Al2O3 spectrum. It is found that the γ-Al2O3 phase consists of Al sites with local structures similar to those found in the δ-Al2O3 and θ-Al2O3 phases albeit with less ordering. Spin-lattice relaxation time measurement further confirms the disordering of the lattice. Collectively, this study uniquely assigns 27Al features in transition aluminas, offering a simplified method to quantify complex mixtures of aluminum sites in transition alumina samples.Carbonic anhydrases (CAs) catalyze the physiological hydration of carbon dioxide and are among the most intensely studied pharmaceutical target enzymes. A hallmark of CA inhibition is the complexation of the catalytic zinc cation in the active site. Human (h) CA isoforms belonging to different families are implicated in a wide range of diseases and of very high interest for therapeutic intervention. Given the conserved catalytic mechanisms and high similarity of many hCA isoforms, a major challenge for CA-based therapy is achieving inhibitor selectivity for hCA isoforms that are associated with specific pathologies over other widely distributed isoforms such as hCA I or hCA II that are of critical relevance for the integrity of many physiological processes. To address this challenge, we have attempted to predict compounds that are selective for isoform hCA IX, which is a tumor-associated protein and implicated in metastasis, over hCA II on the basis of a carefully curated data set of selective and nonselective inhibitors. Machine learning achieved surprisingly high accuracy in predicting hCA IX-selective inhibitors. The results were further investigated, and compound features determining successful predictions were identified. These features were then studied on the basis of X-ray structures of hCA isoform-inhibitor complexes and found to include substructures that explain compound selectivity. Our findings lend credence to selectivity predictions and indicate that the machine learning models derived herein have considerable potential to aid in the identification of new hCA IX-selective compounds.High-pressure carbon monoxide (HiPCO) single-walled carbon nanotubes (SWCNTs) were heat treated at high temperatures from 1700 to 3000 °C. During the heating below 2500 °C, the diameters of the SWCNTs gradually increase from ∼1.0 to >1.5 nm, and at the temperatures higher than 2500 °C, double-, triple-, multiwalled carbon nanotubes (MWCNTs) appear as a consequence of the coalescence of SWCNT bundles. It is surprising that most MWCNTs have odd number of walls, such as 3 or 5. The even-odd number effect agrees well with the mechanism of SWCNT bundle coalescence proposed by López M. J. [Phys. Rev. Lett.2002, 89, 255501], in which an SWCNT that templated the layer by layer coalescence of surrounding SWCNTs is responsible for the enrichment of MWCNTs with odd number of walls. This study confirms the mechanism of SWCNT bundle coalescence, discovers an interesting odd-even number of walls effect in the consequent MWCNTs, and suggests that it is possible to obtain structure-controllable MWCNTs via SWCNT bundle coalescence.A ≥ 200 °C fraction (CT200F) of low-temperature coal tar was prepared by a rotary film evaporator. The catalytic conversion experiments of CT200F and six model compounds were conducted on the pyrolysis gas chromatography-mass spectrometer. The yields of catalytic conversion products benzene, toluene, xylene, and naphthalene (BTXN) were analyzed by semi-quantitative analysis according to the chromatographic peak areas. Additionally, the possible formation pathways and mechanisms of the target products BTXN generated over different catalysts were investigated. The results show that the yield of aromatic hydrocarbons increases and the yield of acid compounds decreases during CT200F pyrolysis over ZSM-5, HY, USY, and β-zeolite compared with that of its non-catalytic pyrolysis, especially the yields of BTXN obtained over USY and β-zeolite increase by 128 and 108%, respectively. The pore structure of ZSM-5 is suitable to produce BTX, while the suitable acidity and pore structure of USY, HY, and β-zeolite are more bcan be effectively utilized.In this report, two chromotrope dyes, chromotropic acid (CA) and chromotrope 2R (CR), were explored as inhibitors against mild steel corrosion in 1.0 M sulfuric acid solutions at 303 K. Electrochemical, spectroscopic, chemical, and microscopic techniques, namely, potentiodynamic polarization (PDP), electrochemical impedance spectroscopy, mass loss, and scanning electron microscopy (SEM), have been employed to evaluate the inhibition efficiencies (%IEs) of the examined organic dyes. The %IEs were found to increase with the inhibitors' concentrations, while they decreased with rising temperature. The outcomes of the PDP technique displayed that the examined inhibitors operated as mixed-type inhibitors with anodic prevalence. The impedance spectra described by Nyquist and Bode graphs in the corrosive environment and in the presence of various concentrations of the examined inhibitors showed single depressed capacitive loops and one-time constants. This behavior signified that the mild steel corrosion was managed by the charge transfer process. The SEM micrographs of the surfaces of mild steel samples after adding the examined inhibitors revealed a wide coverage of these compounds on the steel surfaces. Thus, the acquired high %IEs of the examined inhibitors were interpreted by strong adsorption of the organic molecules on the mild steel surface. This constructed a shielding layer separating the alloy surface from the corrosive medium, and such adsorption was found to follow the Langmuir isotherm. Furthermore, the evaluated thermodynamic and kinetic parameters supported that the nature of such adsorption was mainly physical. Results obtained from all employed techniques were consistent with each other and revealed that the %IE of the CR inhibitor was slightly higher than that of CA under similar circumstances. https://www.selleckchem.com/products/Puromycin-2HCl.html Finally, the mechanisms of both corrosion of mild steel in sulfuric acid solutions and its inhibition by the tested organic dyes were also discussed.