Results 191 to 200 of about 22,450 (237)

Hydrogen Bond Enhanced Halogen Bonds: A Synergistic Interaction in Chemistry and Biochemistry. [PDF]

Acc Chem Res, 2019
Riel AMS, Rowe RK, Ho EN, Carlsson AC, Rappé AK, Berryman OB, Ho PS.   +6 more
europepmc   +1 more source

Halogen Bonds in 2,5-Dihalopyridine-Copper(I) Halide Coordination Polymers. [PDF]

Materials (Basel), 2019
von Essen C, Rissanen K, Puttreddy R.
europepmc   +1 more source

The many flavours of halogen bonds - message from experimental electron density and Raman spectroscopy. [PDF]

Acta Crystallogr C Struct Chem, 2019
Wang R, George J, Potts SK, Kremer M, Dronskowski R, Englert U.   +5 more
europepmc   +1 more source

Exploring Halogen Bonds in 5-Hydroxytryptamine 2B Receptor-Ligand Interactions. [PDF]

ACS Med Chem Lett, 2018
Zhou Y, Wang Y, Li P, Huang XP, Qi X, Du Y, Huang N.   +6 more
europepmc   +1 more source

Anomeric Amide Enabled Divergent Synthesis of Unsymmetrical Ureas, Carbamates, Thioesters, and Amides From Aldehydes

Angewandte Chemie International Edition, EarlyView.
An anomeric amide‐enabled divergent aldehyde functionalization sequence provides one‐pot access to unsymmetrical ureas, carbamates, thiocarbamates, thioesters, and amides. Key to this transformation is the formation of N‐Boc‐hydroxamate intermediates, which serve as platforms for orthogonal activation via Lossen‐type rearrangements, single‐electron ...
Jasper L. Tyler, Meiyi Zeng, Julius Wiener, Marie‐Christin Leusmann, Colin Stein, Constantin G. Daniliuc, Frank Glorius   +6 more
wiley   +1 more source

First‐Principles Investigation of the Structural, Electronic, Optical, Elastic, and Thermal Properties of Defect Diamond‐Like Hg3P2S8

Advanced Physics Research, EarlyView.
The defect diamond‐like material Hg3P2S8 (HPS) is systematically investigated using first‐principles methods to reveal the interplay between highly distorted HgS4 and rigid PS4 units. The HPS material exhibits a strong anisotropic second‐harmonic generation (SHG) response, favorable optical properties, and low thermal conductivity, highlighting its ...
Saravana Karthikeyan SKS, Sankar Ganesh Ramaraj, Ryo Watanabe, Choji Fukuhara, Chang Yi Kong   +4 more
wiley   +1 more source

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Halogen bond-induced electrophilic aromatic halogenations

Organic & Biomolecular Chemistry, 2021
This review highlights the recent development of halogen bond-induced activations of N-halosuccinimides and N,N-dihalodimethylhydantoins in electrophilic aromatic halogenations.
Wanutcha Lorpaiboon, Pakorn Bovonsombat
openaire   +2 more sources

Halogen bonding in solution

Chemical Society Reviews, 2012
Halogen bonding is the electron density donation based weak interaction of halogens with Lewis bases. Its applicability for molecular recognition processes long remained unappreciated and has so far mostly been studied in silico and in solid state.
Erdelyi, M.
openaire   +2 more sources

On The Nature of the Halogen Bond

Journal of Chemical Theory and Computation, 2014
The wide-ranging applications of the halogen bond (X-bond), notably in self-assembling materials and medicinal chemistry, have placed this weak intermolecular interaction in a center of great deal of attention. There is a need to elucidate the physical nature of the halogen bond for better understanding of its similarity and differences vis-à-vis other
Changwei, Wang, David, Danovich, Yirong, Mo, Sason, Shaik   +3 more
openaire   +2 more sources

On the directionality of halogen bonding

Physical Chemistry Chemical Physics, 2013
The origin of the high directionality of halogen bonding was investigated quantum chemically by a detailed comparison of typical adducts in two different orientations: linear (most stable) and perpendicular. Energy decomposition analyses revealed that the synergy between charge-transfer interactions and Pauli repulsion are the driving forces for the ...
Stefan M, Huber, Joseph D, Scanlon, Elisa, Jimenez-Izal, Jesus M, Ugalde, Ivan, Infante   +4 more
openaire   +2 more sources