Results 91 to 100 of about 19,455 (274)

Tuning the optical properties of NLO push-pull chromophores through halogen bonding. [PDF]

open access: yes, 2014
Among linear -conjugated organic molecules displaying strong second order nonlinear optical (NLO) and emissive properties, p-phenylene vinylene (PPV) derivatives are of particular interest, due to their broad absorption bands and high luminescence ...
RESNATI, GIUSEPPE   +8 more
core  

On the Interplay between Charge‐Shift Bonding and Halogen Bonding [PDF]

open access: yes, 2020
International audienceThe nature of halogen-bond interactions has been analysed from the perspective of the astatine element, which is potentially the strongest halogen-bond donor.
Jérôme Graton   +9 more
core   +1 more source

Halogen bonds 4: The strongest (?) halogen bond.

open access: yes, 2014
Continuing my hunt, here is a candidate for a strong(est?) halogen bond, this time between Se and I.[cite]10.1021/ic50038a006[/cite]. The features of interest include: The six-membered ring is in the chair conformation.
openaire   +1 more source

Site Selectivity of Halogen Oxygen Bonding in 5- and 6-Haloderivatives of Uracil

open access: yesCrystals, 2019
Seven 5-and 6-halogenated derivatives of uracil or 1-methyluracil (halogen = Cl, Br, I) were studied by single crystal X-ray diffraction. In contrast with pure 5-halouracils, where the presence of N-H⋯O and C-H⋯O hydrogen bonds prevents the formation of ...
Gustavo Portalone
doaj   +1 more source

Organic Materials of Tomorrow: Horizons of Artificial Intelligence

open access: yesAdvanced Materials, EarlyView.
This review examines machine learning techniques accelerating the discovery of organic semiconductors by linking molecular structure to properties. Key methods include graph neural networks, generative models, and active learning. Applications to organic photovoltaics demonstrate practical impact.
Harold Mena   +3 more
wiley   +1 more source

Can Elastomers Combine Stiffness, Toughness and Fatigue Resistance?

open access: yesAdvanced Materials, EarlyView.
This review studies how the molecular and macroscopic architecture of elastomers influence their mechanical properties including: stiffness, stretchability, toughness, fatigue resistance, and damping behavior. By linking the structure to performance, it proposes design principles for advanced elastomeric systems that combine mechanical properties ...
Eva Baur, Esther Amstad
wiley   +1 more source

Halogen cation transfer in halogen bonding catalysis [PDF]

open access: yes
The potential of fluorine to participate in halogen bonding (XB) has remained a subject of ongoing debate. The discovery of N-fluoropyridinium triflate as a unique "F-cation organocatalyst" for aziridine synthesis is considered to be the first reported ...
Tan, Hao-Dong   +3 more
core   +1 more source

A Chemical Framework for Engineering Extracellular Vesicles’ Biointerface to Advance Precision Therapeutics

open access: yesAdvanced Materials, EarlyView.
Extracellular vesicles (EVs) are cell‐derived nanoparticles that mediate intercellular communication through their dynamic biointerfaces. Owing to their intrinsic biological functions, EVs have emerged as promising platforms for biomedical applications.
Leila Pourtalebi Jahromi   +3 more
wiley   +1 more source

Halogen Bonding: A Halogen-Centered Noncovalent Interaction Yet to Be Understood

open access: yesInorganics, 2019
In addition to the underlying basic concepts and early recognition of halogen bonding, this paper reviews the conflicting views that consistently appear in the area of noncovalent interactions and the ability of covalently bonded halogen atoms in ...
Pradeep R. Varadwaj   +2 more
doaj   +1 more source

Advances in Halide Perovskites for Photon Radiation Detectors

open access: yesAdvanced Materials Technologies, EarlyView.
This work highlights recent progress in perovskite‐based photon radiation detectors, covering organic–inorganic hybrid, inorganic, lead‐free double, and vacancy‐ordered halide perovskites. Their detection performance is compared, material‐specific advantages and challenges are examined, and provides insight into current limitations and future ...
Liangling Wang   +3 more
wiley   +1 more source

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