Results 31 to 40 of about 837,919 (319)

Methyl 2-[(ferrocenylcarbonyl)amino]thiophene-3-carboxylate [PDF]

open access: yes, 2005
The title compound, [Fe(C₅H₅)(C₁₂H₁₀NO₃S)], was synthesized from ferrocenecarboxylic acid and methyl 2-aminothiophene-3-carboxylate in modest yield. The substituted ring system is essentially planar through the amidothienylcarboxylate moiety, η⁵-(C₅H₄ ...
Alley, Steven   +3 more
core   +1 more source

Bis(dimethylammonium) 2,5-dihydroxybenzene-1,4-disulfonate

open access: yesActa Crystallographica Section E, 2012
In the crystal of the title salt, 2C2H8N+·C6H4O8S22−, the anion lies on a center of inversion. The dimethylammonium cation forms one N—H...O hydrogen bond and another bifurcated N—H...O hydrogen bond.
Shan Gao, Seik Weng Ng
doaj   +1 more source

Identification of the protonation and oxidation states of the oxygen-evolving complex in the low-dose X-ray crystal structure of photosystem II

open access: yesFrontiers in Plant Science, 2023
In photosystem II (PSII), the O3 and O4 sites of the Mn4CaO5 cluster form hydrogen bonds with D1-His337 and a water molecule (W539), respectively. The low-dose X-ray structure shows that these hydrogen bond distances differ between the two homogeneous ...
Keisuke Saito   +4 more
doaj   +1 more source

(E)-4-Hydroxy-N′-(2-hydroxy-4-methoxybenzylidene)benzohydrazide monohydrate

open access: yesActa Crystallographica Section E, 2009
The Schiff base molecule of the title compound, C15H14N2O4·H2O, adopts a trans configuration with respect to the C=N double bond; the Schiff base itself is almost planar (r.m.s. deviation for all non-H atoms = 0.040 Å).
Nooraziah Mohd Lair   +2 more
doaj   +1 more source

Intramolecular Hydrogen Bond Energy and Its Decomposition—O–H∙∙∙O Interactions

open access: yesCrystals, 2020
The method to calculate the energy of intramolecular hydrogen bond is proposed and tested for a sample of malonaldehyde and its fluorine derivatives; the corresponding calculations were performed at the ωB97XD/aug-cc-pVTZ level.
Sławomir J. Grabowski
doaj   +1 more source

The 6-vertex model of hydrogen-bonded crystals with bond defects [PDF]

open access: yes, 1999
It is shown that the percolation model of hydrogen-bonded crystals, which is a 6-vertex model with bond defects, is completely equivalent with an 8-vertex model in an external electric field.
Chin-Kun Hu   +11 more
core   +1 more source

Salicylaldehyde hydrazones: buttressing of outer sphere hydrogen-bonding and copper-extraction properties [PDF]

open access: yes, 2017
Salicylaldehyde hydrazones are weaker copper extractants than their oxime derivatives, which are used in hydrometallurgical processes to recover ~20 % of the world’s copper.
Bauer, Heiko   +7 more
core   +1 more source

Theoretical Study of Heteroatom Resonance-Assisted Hydrogen Bond: Effect of Substituent on π-delocalization [PDF]

open access: yesIranian Journal of Chemistry & Chemical Engineering, 2010
The concept of Resonance Assisted Hydrogen Bond (RAHB), which usually occurs in b diketons, has a remarkable role in chemistry. These molecules, which contain heteroatom particularly O and N, are species with biological interest in protein folding and ...
Ali Heydar Pakiari, Maryam Farrokhnia
doaj  

Interaction vesicles as emerging mediators of host‐pathogen molecular crosstalk and their implications for infection dynamics

open access: yesFEBS Letters, EarlyView.
Interaction extracellular vesicles (iEVs) are hybrid vesicles formed through host‐pathogen communication. They facilitate immune evasion, transfer pathogens' molecules, increase host cell uptake, and enhance virulence. This Perspective article illustrates the multifunctional roles of iEVs and highlights their emerging relevance in infection dynamics ...
Bruna Sabatke   +2 more
wiley   +1 more source

The Characteristics of PD-L1 Inhibitors, from Peptides to Small Molecules

open access: yesMolecules, 2019
The programmed cell death ligand protein 1 (PD-L1) is a member of the B7 protein family and consists of 290 amino acid residues. The blockade of the PD-1/PD-L1 immune checkpoint pathway is effective in tumor treatment.
Yanwen Zhong   +3 more
doaj   +1 more source

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