Results 1 to 10 of about 114,432 (116)
Intermolecular Covalent Interactions: Nature and Directionality
AbstractQuantum chemical methods were employed to analyze the nature and the origin of the directionality of pnictogen (PnB), chalcogen (ChB), and halogen bonds (XB) in archetypal FmZ⋅⋅⋅F− complexes (Z=Pn, Ch, X), using relativistic density functional theory (DFT) at ZORA‐M06/QZ4P.
Lucas de Azevedo Santos +3 more
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Phosphate Stabilization of Intermolecular Interactions [PDF]
Receptor heteromerization is an important phenomenon that results from the interaction of epitopes on two receptors. Previous studies have suggested the possibility of Dopamine D2-NMDA receptors' interaction. We believe that the interaction is through an acidic epitope of the NMDA NR1 subunit (KVNSEEEEEDA) and a basic epitope of the D2 third ...
Shelley N, Jackson +3 more
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Studies of pilocarpine:carbomer intermolecular interactions
The interactions between pilocarpine (PIL) and the anionic polyelectrolyte carbomer (CBR) were investigated. The effects of the chemical interactions on the chemical stability of the drug also were evaluated. The binary system was characterized by nuclear magnetic resonance techniques, Fourier-transform infrared spectroscopy (FT-IR), X-ray powder ...
Zoppi, Ariana +6 more
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Intermolecular interactions in solid benzene
The lattice dynamics and molecular vibrations of benzene and deuterated benzene crystals are calculated from force constants derived from density-functional theory (DFT) calculations and compared with measured inelastic neutron-scattering spectra. A very small change (0.5%) in lattice parameter is required to obtain real lattice-mode frequencies across
Kearley, G.J. (author) +2 more
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Citation: 'intermolecular interactions' in the IUPAC Compendium of Chemical Terminology, 5th ed.; International Union of Pure and Applied Chemistry; 2025. Online version 5.0.0, 2025. 10.1351/goldbook.09873 • License: The IUPAC Gold Book is licensed under Creative Commons Attribution-ShareAlike CC BY-SA 4.0 International for individual terms.
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Intramolecular and Intermolecular Interaction Switching in the Aggregates of Perylene Diimide Trimer: Effect of Hydrophobicity. [PDF]
Su P +6 more
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The intermolecular interactions in the aminonitromethylbenzenes
Abstract The intermolecular non-covalent interactions in aminonitromethylbenzenes namely 2-methyl-4-nitroaniline, 4-methyl-3-nitroaniline, 2-methyl-6-nitroaniline, 4-amino-2,6-dinitrotoluene, 2-methyl-5-nitroaniline, 4-methyl-2-nitroaniline, 2,3-dimethyl-6-nitroaniline, 4,5-dimethyl-2-nitroaniline and 2-methyl-3,5-dinitroaniline were ...
Rafal Kruszynski, Tomasz Sieranski
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The Role of Intermolecular Interaction on Aggregation-Induced Emission Phenomenon and OLED Performance. [PDF]
Filipek P +4 more
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Molecular doping of nucleic acids into light emitting crystals driven by multisite-intermolecular interaction. [PDF]
Jung WH, Park JH, Kim S, Cui C, Ahn DJ.
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Theory of Intermolecular Interaction
Abstract The method of orbital interaction describing the intermolecular interaction is reformulated in terms of Green’s function. The eigen-values and eigen-vectors for individual molecules obtained by block diagonalization of the original Hamiltonian, are sufficient to predict the next step of the reaction.
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